butyl 4-[(4-methanoylpiperazin-1-yl)carbonylamino]benzoate

Systemtic Name: butyl 4-[(4-methanoylpiperazin-1-yl)carbonylamino]benzoate Openeye Name: butyl 4-[(4-formylpiperazine-1-carbonyl)amino]benzoate CAS Name: 4-[[(4-formyl-1-piperazinyl)-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(4-formylpiperazine-1-carbonyl)amino]benzoate Traditional Name: 4-[(4-formylpiperazine-1-carbonyl)amino]benzoic acid butyl ester Formula: C17H23N3O4 MolecularWeight: 333.38222

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)C=O

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)C=O

InChI

InChI=1S/C17H23N3O4/c1-2-3-12-24-16(22)14-4-6-15(7-5-14)18-17(23)20-10-8-19(13-21)9-11-20/h4-7,13H,2-3,8-12H2,1H3,(H,18,23)