[(8-oxidanylidene-8-phenylazanyl-octanoyl)amino] 4-methylbenzoate

Systemtic Name: [(8-oxidanylidene-8-phenylazanyl-octanoyl)amino] 4-methylbenzoate Openeye Name: [(8-anilino-8-oxo-octanoyl)amino] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [(8-anilino-1,8-dioxooctyl)amino] ester IUPAC Name: [(8-anilino-8-oxooctanoyl)amino] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [(8-anilino-8-keto-octanoyl)amino] ester Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)ONC(=O)CCCCCCC(=O)NC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)ONC(=O)CCCCCCC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C22H26N2O4/c1-17-13-15-18(16-14-17)22(27)28-24-21(26)12-8-3-2-7-11-20(25)23-19-9-5-4-6-10-19/h4-6,9-10,13-16H,2-3,7-8,11-12H2,1H3,(H,23,25)(H,24,26)