2-phenoxyethyl 2-methylidene-4-(4-methyl-3-nitro-phenyl)-5-oxidanylidene-7-thiophen-2-yl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate

Systemtic Name: 2-phenoxyethyl 2-methylidene-4-(4-methyl-3-nitro-phenyl)-5-oxidanylidene-7-thiophen-2-yl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Openeye Name: 2-phenoxyethyl 2-methylene-4-(4-methyl-3-nitro-phenyl)-5-oxo-7-(2-thienyl)-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate CAS Name: 2-methylene-4-(4-methyl-3-nitrophenyl)-5-oxo-7-thiophen-2-yl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl 2-methylidene-4-(4-methyl-3-nitrophenyl)-5-oxo-7-thiophen-2-yl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Traditional Name: 5-keto-2-methylene-4-(4-methyl-3-nitro-phenyl)-7-(2-thienyl)-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid 2-phenoxyethyl ester Formula: C30H28N2O6S MolecularWeight: 544.61812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2C(C(=C)NC3=C2C(=O)CC(C3)C4=CC=CS4)C(=O)OCCOC5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C2C(C(=C)NC3=C2C(=O)CC(C3)C4=CC=CS4)C(=O)OCCOC5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C30H28N2O6S/c1-18-10-11-20(16-24(18)32(35)36)28-27(30(34)38-13-12-37-22-7-4-3-5-8-22)19(2)31-23-15-21(17-25(33)29(23)28)26-9-6-14-39-26/h3-11,14,16,21,27-28,31H,2,12-13,15,17H2,1H3