[2-[(9-ethylcarbazol-3-yl)amino]-2-oxidanylidene-ethyl] 4-(4-chloranyl-2-methyl-phenoxy)butanoate

Systemtic Name: [2-[(9-ethylcarbazol-3-yl)amino]-2-oxidanylidene-ethyl] 4-(4-chloranyl-2-methyl-phenoxy)butanoate Openeye Name: [2-[(9-ethylcarbazol-3-yl)amino]-2-oxo-ethyl] 4-(4-chloro-2-methyl-phenoxy)butanoate CAS Name: 4-(4-chloro-2-methylphenoxy)butanoic acid [2-[(9-ethyl-3-carbazolyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(9-ethylcarbazol-3-yl)amino]-2-oxoethyl] 4-(4-chloro-2-methylphenoxy)butanoate Traditional Name: 4-(4-chloro-2-methyl-phenoxy)butyric acid [2-[(9-ethylcarbazol-3-yl)amino]-2-keto-ethyl] ester Formula: C27H27ClN2O4 MolecularWeight: 478.96728

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)COC(=O)CCCOC3=C(C=C(C=C3)Cl)C)C4=CC=CC=C41

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)COC(=O)CCCOC3=C(C=C(C=C3)Cl)C)C4=CC=CC=C41

InChI

InChI=1S/C27H27ClN2O4/c1-3-30-23-8-5-4-7-21(23)22-16-20(11-12-24(22)30)29-26(31)17-34-27(32)9-6-14-33-25-13-10-19(28)15-18(25)2/h4-5,7-8,10-13,15-16H,3,6,9,14,17H2,1-2H3,(H,29,31)