3-methylbutyl 4-[(3-nitrophenyl)carbonylamino]benzoate

Systemtic Name: 3-methylbutyl 4-[(3-nitrophenyl)carbonylamino]benzoate Openeye Name: isopentyl 4-[(3-nitrobenzoyl)amino]benzoate CAS Name: 4-[[(3-nitrophenyl)-oxomethyl]amino]benzoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 4-[(3-nitrobenzoyl)amino]benzoate Traditional Name: 4-[(3-nitrobenzoyl)amino]benzoic acid isoamyl ester Formula: C19H20N2O5 MolecularWeight: 356.3725

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H20N2O5/c1-13(2)10-11-26-19(23)14-6-8-16(9-7-14)20-18(22)15-4-3-5-17(12-15)21(24)25/h3-9,12-13H,10-11H2,1-2H3,(H,20,22)