methyl (4aR,8R,8aR)-4a-ethyl-8-(2-nitrophenyl)-7-oxidanylidene-5,6,8,8a-tetrahydro-2H-quinoline-1-carboxylate

Systemtic Name: methyl (4aR,8R,8aR)-4a-ethyl-8-(2-nitrophenyl)-7-oxidanylidene-5,6,8,8a-tetrahydro-2H-quinoline-1-carboxylate Openeye Name: methyl (4aR,8R,8aR)-4a-ethyl-8-(2-nitrophenyl)-7-oxo-5,6,8,8a-tetrahydro-2H-quinoline-1-carboxylate CAS Name: (4aR,8R,8aR)-4a-ethyl-8-(2-nitrophenyl)-7-oxo-5,6,8,8a-tetrahydro-2H-quinoline-1-carboxylic acid methyl ester IUPAC Name: methyl (4aR,8R,8aR)-4a-ethyl-8-(2-nitrophenyl)-7-oxo-5,6,8,8a-tetrahydro-2H-quinoline-1-carboxylate Traditional Name: (4aR,8R,8aR)-4a-ethyl-7-keto-8-(2-nitrophenyl)-5,6,8,8a-tetrahydro-2H-quinoline-1-carboxylic acid methyl ester Formula: C19H22N2O5 MolecularWeight: 358.38838

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Descriptors Computed from Structure

Canonical SMILES:

CCC12CCC(=O)C(C1N(CC=C2)C(=O)OC)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC[C@]12CCC(=O)[C@@H]([C@H]1N(CC=C2)C(=O)OC)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H22N2O5/c1-3-19-10-6-12-20(18(23)26-2)17(19)16(15(22)9-11-19)13-7-4-5-8-14(13)21(24)25/h4-8,10,16-17H,3,9,11-12H2,1-2H3/t16-,17+,19-/m0/s1