phenethyl 4-[[3-(cyclopropylcarbonylamino)-2-methyl-phenyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: phenethyl 4-[[3-(cyclopropylcarbonylamino)-2-methyl-phenyl]amino]-4-oxidanylidene-butanoate Openeye Name: phenethyl 4-[3-(cyclopropanecarbonylamino)-2-methyl-anilino]-4-oxo-butanoate CAS Name: 4-[3-[[cyclopropyl(oxo)methyl]amino]-2-methylanilino]-4-oxobutanoic acid phenethyl ester IUPAC Name: phenethyl 4-[3-(cyclopropanecarbonylamino)-2-methylanilino]-4-oxobutanoate Traditional Name: 4-[3-(cyclopropanecarbonylamino)-2-methyl-anilino]-4-keto-butyric acid phenethyl ester Formula: C23H26N2O4 MolecularWeight: 394.46354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)CCC(=O)OCCC2=CC=CC=C2)NC(=O)C3CC3

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)CCC(=O)OCCC2=CC=CC=C2)NC(=O)C3CC3

InChI

InChI=1S/C23H26N2O4/c1-16-19(8-5-9-20(16)25-23(28)18-10-11-18)24-21(26)12-13-22(27)29-15-14-17-6-3-2-4-7-17/h2-9,18H,10-15H2,1H3,(H,24,26)(H,25,28)