methyl 3-[[4-(2-methylpropanoylamino)phenyl]carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[[4-(2-methylpropanoylamino)phenyl]carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[[4-(2-methylpropanoylamino)phenyl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[4-[(2-methyl-1-oxopropyl)amino]anilino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[[4-(2-methylpropanoylamino)phenyl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[4-(isobutyrylamino)phenyl]carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C19H19N3O6 MolecularWeight: 385.37066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C19H19N3O6/c1-11(2)17(23)20-14-4-6-15(7-5-14)21-18(24)12-8-13(19(25)28-3)10-16(9-12)22(26)27/h4-11H,1-3H3,(H,20,23)(H,21,24)