dodecyl 3-[[2-[4-[(2E)-2-[5-acetamido-1-oxidanylidene-4-(trioxidanylsulfanyl)naphthalen-2-ylidene]hydrazinyl]phenoxy]-3-(4-methoxyphenyl)-3-oxidanylidene-propanoyl]amino]-4-chloranyl-benzoate

Systemtic Name: dodecyl 3-[[2-[4-[(2E)-2-[5-acetamido-1-oxidanylidene-4-(trioxidanylsulfanyl)naphthalen-2-ylidene]hydrazinyl]phenoxy]-3-(4-methoxyphenyl)-3-oxidanylidene-propanoyl]amino]-4-chloranyl-benzoate Openeye Name: dodecyl 3-[[2-[4-[(2E)-2-[5-acetamido-1-oxo-4-(trioxidanylsulfanyl)-2-naphthylidene]hydrazino]phenoxy]-3-(4-methoxyphenyl)-3-oxo-propanoyl]amino]-4-chloro-benzoate CAS Name: 3-[[2-[4-[(2E)-2-[5-acetamido-1-oxo-4-(trioxidanylthio)-2-naphthalenylidene]hydrazinyl]phenoxy]-3-(4-methoxyphenyl)-1,3-dioxopropyl]amino]-4-chlorobenzoic acid dodecyl ester IUPAC Name: dodecyl 3-[[2-[4-[(2E)-2-[5-acetamido-1-oxo-4-(trioxidanylsulfanyl)naphthalen-2-ylidene]hydrazinyl]phenoxy]-3-(4-methoxyphenyl)-3-oxopropanoyl]amino]-4-chlorobenzoate Traditional Name: 3-[[2-[4-[(N'E)-N'-[5-acetamido-1-keto-4-(trioxidanylthio)-2-naphthylidene]hydrazino]phenoxy]-3-keto-3-(4-methoxyphenyl)propanoyl]amino]-4-chloro-benzoic acid lauryl ester Formula: C47H51ClN4O11S MolecularWeight: 915.44604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C1=CC(=C(C=C1)Cl)NC(=O)C(C(=O)C2=CC=C(C=C2)OC)OC3=CC=C(C=C3)NN=C4C=C(C5=C(C4=O)C=CC=C5NC(=O)C)SOOO

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C1=CC(=C(C=C1)Cl)NC(=O)C(C(=O)C2=CC=C(C=C2)OC)OC3=CC=C(C=C3)N/N=C/4\C=C(C5=C(C4=O)C=CC=C5NC(=O)C)SOOO

InChI

InChI=1S/C47H51ClN4O11S/c1-4-5-6-7-8-9-10-11-12-13-27-60-47(57)32-19-26-37(48)39(28-32)50-46(56)45(43(54)31-17-22-34(59-3)23-18-31)61-35-24-20-33(21-25-35)51-52-40-29-41(64-63-62-58)42-36(44(40)55)15-14-16-38(42)49-30(2)53/h14-26,28-29,45,51,58H,4-13,27H2,1-3H3,(H,49,53)(H,50,56)/b52-40+