(2,2,4-trimethyl-3,4-dihydro-1H-quinolin-6-yl) 2-methyl-3-nitro-benzoate

Systemtic Name: (2,2,4-trimethyl-3,4-dihydro-1H-quinolin-6-yl) 2-methyl-3-nitro-benzoate Openeye Name: (2,2,4-trimethyl-3,4-dihydro-1H-quinolin-6-yl) 2-methyl-3-nitro-benzoate CAS Name: 2-methyl-3-nitrobenzoic acid (2,2,4-trimethyl-3,4-dihydro-1H-quinolin-6-yl) ester IUPAC Name: (2,2,4-trimethyl-3,4-dihydro-1H-quinolin-6-yl) 2-methyl-3-nitrobenzoate Traditional Name: 2-methyl-3-nitro-benzoic acid (2,2,4-trimethyl-3,4-dihydro-1H-quinolin-6-yl) ester Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(NC2=C1C=C(C=C2)OC(=O)C3=C(C(=CC=C3)[N+](=O)[O-])C)(C)C

Isomeric SMILES

CC1CC(NC2=C1C=C(C=C2)OC(=O)C3=C(C(=CC=C3)[N+](=O)[O-])C)(C)C

InChI

InChI=1S/C20H22N2O4/c1-12-11-20(3,4)21-17-9-8-14(10-16(12)17)26-19(23)15-6-5-7-18(13(15)2)22(24)25/h5-10,12,21H,11H2,1-4H3