methyl 3-[(4-nitrophenyl)carbonylamino]-4-pyrrolidin-1-yl-benzoate

Systemtic Name: methyl 3-[(4-nitrophenyl)carbonylamino]-4-pyrrolidin-1-yl-benzoate Openeye Name: methyl 3-[(4-nitrobenzoyl)amino]-4-pyrrolidin-1-yl-benzoate CAS Name: 3-[[(4-nitrophenyl)-oxomethyl]amino]-4-(1-pyrrolidinyl)benzoic acid methyl ester IUPAC Name: methyl 3-[(4-nitrobenzoyl)amino]-4-pyrrolidin-1-ylbenzoate Traditional Name: 3-[(4-nitrobenzoyl)amino]-4-pyrrolidino-benzoic acid methyl ester Formula: C19H19N3O5 MolecularWeight: 369.37126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)N2CCCC2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)N2CCCC2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O5/c1-27-19(24)14-6-9-17(21-10-2-3-11-21)16(12-14)20-18(23)13-4-7-15(8-5-13)22(25)26/h4-9,12H,2-3,10-11H2,1H3,(H,20,23)