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

Systemtic Name: 2-phenoxyethyl 4-(3-methoxy-5-nitro-4-oxidanyl-phenyl)-2-methylidene-5-oxidanylidene-7-thiophen-2-yl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Openeye Name: 2-phenoxyethyl 4-(4-hydroxy-3-methoxy-5-nitro-phenyl)-2-methylene-5-oxo-7-(2-thienyl)-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate CAS Name: 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-2-methylene-5-oxo-7-thiophen-2-yl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-2-methylidene-5-oxo-7-thiophen-2-yl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Traditional Name: 4-(4-hydroxy-3-methoxy-5-nitro-phenyl)-5-keto-2-methylene-7-(2-thienyl)-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid 2-phenoxyethyl ester Formula: C30H28N2O8S MolecularWeight: 576.61692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)[N+](=O)[O-])C2C(C(=C)NC3=C2C(=O)CC(C3)C4=CC=CS4)C(=O)OCCOC5=CC=CC=C5

Isomeric SMILES

COC1=CC(=CC(=C1O)[N+](=O)[O-])C2C(C(=C)NC3=C2C(=O)CC(C3)C4=CC=CS4)C(=O)OCCOC5=CC=CC=C5

InChI

InChI=1S/C30H28N2O8S/c1-17-26(30(35)40-11-10-39-20-7-4-3-5-8-20)27(19-14-22(32(36)37)29(34)24(16-19)38-2)28-21(31-17)13-18(15-23(28)33)25-9-6-12-41-25/h3-9,12,14,16,18,26-27,31,34H,1,10-11,13,15H2,2H3