butyl 4-[(4-ethanoyl-1,4-diazepan-1-yl)carbonylamino]benzoate

Systemtic Name: butyl 4-[(4-ethanoyl-1,4-diazepan-1-yl)carbonylamino]benzoate Openeye Name: butyl 4-[(4-acetyl-1,4-diazepane-1-carbonyl)amino]benzoate CAS Name: 4-[[(4-acetyl-1,4-diazepan-1-yl)-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(4-acetyl-1,4-diazepane-1-carbonyl)amino]benzoate Traditional Name: 4-[(4-acetyl-1,4-diazepane-1-carbonyl)amino]benzoic acid butyl ester Formula: C19H27N3O4 MolecularWeight: 361.43538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)N2CCCN(CC2)C(=O)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)N2CCCN(CC2)C(=O)C

InChI

InChI=1S/C19H27N3O4/c1-3-4-14-26-18(24)16-6-8-17(9-7-16)20-19(25)22-11-5-10-21(12-13-22)15(2)23/h6-9H,3-5,10-14H2,1-2H3,(H,20,25)