2-methoxy-4-[7-(2-methoxyphenyl)-2-methylidene-5-oxidanylidene-3-propoxycarbonyl-1,3,4,6,7,8-hexahydroquinolin-4-yl]-6-nitro-phenolate

Systemtic Name: 2-methoxy-4-[7-(2-methoxyphenyl)-2-methylidene-5-oxidanylidene-3-propoxycarbonyl-1,3,4,6,7,8-hexahydroquinolin-4-yl]-6-nitro-phenolate Openeye Name: 2-methoxy-4-[7-(2-methoxyphenyl)-2-methylene-5-oxo-3-propoxycarbonyl-1,3,4,6,7,8-hexahydroquinolin-4-yl]-6-nitro-phenolate CAS Name: 2-methoxy-4-[7-(2-methoxyphenyl)-2-methylene-5-oxo-3-[oxo(propoxy)methyl]-1,3,4,6,7,8-hexahydroquinolin-4-yl]-6-nitrophenolate IUPAC Name: 2-methoxy-4-[7-(2-methoxyphenyl)-2-methylidene-5-oxo-3-propoxycarbonyl-1,3,4,6,7,8-hexahydroquinolin-4-yl]-6-nitrophenolate Traditional Name: 4-[5-keto-7-(2-methoxyphenyl)-2-methylene-3-propoxycarbonyl-1,3,4,6,7,8-hexahydroquinolin-4-yl]-2-methoxy-6-nitro-phenolate Formula: C28H29N2O8- MolecularWeight: 521.53846

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1C(C2=C(CC(CC2=O)C3=CC=CC=C3OC)NC1=C)C4=CC(=C(C(=C4)OC)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCOC(=O)C1C(C2=C(CC(CC2=O)C3=CC=CC=C3OC)NC1=C)C4=CC(=C(C(=C4)OC)[O-])[N+](=O)[O-]

InChI

InChI=1S/C28H30N2O8/c1-5-10-38-28(33)24-15(2)29-19-11-16(18-8-6-7-9-22(18)36-3)13-21(31)26(19)25(24)17-12-20(30(34)35)27(32)23(14-17)37-4/h6-9,12,14,16,24-25,29,32H,2,5,10-11,13H2,1,3-4H3/p-1