methyl 3-[[2,6-di(propan-2-yl)phenyl]carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[[2,6-di(propan-2-yl)phenyl]carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[(2,6-diisopropylphenyl)carbamoyl]-5-nitro-benzoate CAS Name: 3-[[2,6-di(propan-2-yl)anilino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[[2,6-di(propan-2-yl)phenyl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[(2,6-diisopropylphenyl)carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O5/c1-12(2)17-7-6-8-18(13(3)4)19(17)22-20(24)14-9-15(21(25)28-5)11-16(10-14)23(26)27/h6-13H,1-5H3,(H,22,24)