methyl 4-[(3-azanyl-3-oxidanylidene-propyl)-(phenylmethyl)carbamoyl]benzoate

Systemtic Name: methyl 4-[(3-azanyl-3-oxidanylidene-propyl)-(phenylmethyl)carbamoyl]benzoate Openeye Name: methyl 4-[(3-amino-3-oxo-propyl)-benzyl-carbamoyl]benzoate CAS Name: 4-[[(3-amino-3-oxopropyl)-(phenylmethyl)amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(3-amino-3-oxopropyl)-benzylcarbamoyl]benzoate Traditional Name: 4-[(3-amino-3-keto-propyl)-benzyl-carbamoyl]benzoic acid methyl ester Formula: C19H20N2O4 MolecularWeight: 340.3731

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)N(CCC(=O)N)CC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)N(CCC(=O)N)CC2=CC=CC=C2

InChI

InChI=1S/C19H20N2O4/c1-25-19(24)16-9-7-15(8-10-16)18(23)21(12-11-17(20)22)13-14-5-3-2-4-6-14/h2-10H,11-13H2,1H3,(H2,20,22)