methyl 3-[(4-tert-butylphenyl)carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[(4-tert-butylphenyl)carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[(4-tert-butylphenyl)carbamoyl]-5-nitro-benzoate CAS Name: 3-[(4-tert-butylanilino)-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[(4-tert-butylphenyl)carbamoyl]-5-nitrobenzoate Traditional Name: 3-[(4-tert-butylphenyl)carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C19H20N2O5 MolecularWeight: 356.3725

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O5/c1-19(2,3)14-5-7-15(8-6-14)20-17(22)12-9-13(18(23)26-4)11-16(10-12)21(24)25/h5-11H,1-4H3,(H,20,22)