methyl 4-[(2-nitro-4-propan-2-yl-phenyl)carbamoyl]benzoate

Systemtic Name: methyl 4-[(2-nitro-4-propan-2-yl-phenyl)carbamoyl]benzoate Openeye Name: methyl 4-[(4-isopropyl-2-nitro-phenyl)carbamoyl]benzoate CAS Name: 4-[(2-nitro-4-propan-2-ylanilino)-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(2-nitro-4-propan-2-ylphenyl)carbamoyl]benzoate Traditional Name: 4-[(4-isopropyl-2-nitro-phenyl)carbamoyl]benzoic acid methyl ester Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O5/c1-11(2)14-8-9-15(16(10-14)20(23)24)19-17(21)12-4-6-13(7-5-12)18(22)25-3/h4-11H,1-3H3,(H,19,21)