methyl 3-[[(4-oxidanylidene-4-phenylazanyl-butanoyl)amino]carbamoyl]benzoate

Systemtic Name: methyl 3-[[(4-oxidanylidene-4-phenylazanyl-butanoyl)amino]carbamoyl]benzoate Openeye Name: methyl 3-[[(4-anilino-4-oxo-butanoyl)amino]carbamoyl]benzoate CAS Name: 3-[[(4-anilino-1,4-dioxobutyl)hydrazo]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[(4-anilino-4-oxobutanoyl)amino]carbamoyl]benzoate Traditional Name: 3-[[(4-anilino-4-keto-butanoyl)amino]carbamoyl]benzoic acid methyl ester Formula: C19H19N3O5 MolecularWeight: 369.37126

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=C1)C(=O)NNC(=O)CCC(=O)NC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=CC=CC(=C1)C(=O)NNC(=O)CCC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C19H19N3O5/c1-27-19(26)14-7-5-6-13(12-14)18(25)22-21-17(24)11-10-16(23)20-15-8-3-2-4-9-15/h2-9,12H,10-11H2,1H3,(H,20,23)(H,21,24)(H,22,25)