ethyl 3-[(3-ethoxycarbonylphenyl)methyl]-1-[(6-ethyl-1,3-benzodioxol-5-yl)methyl]-4-oxidanylidene-6-propoxy-quinoline-2-carboxylate

Systemtic Name: ethyl 3-[(3-ethoxycarbonylphenyl)methyl]-1-[(6-ethyl-1,3-benzodioxol-5-yl)methyl]-4-oxidanylidene-6-propoxy-quinoline-2-carboxylate Openeye Name: ethyl 3-[(3-ethoxycarbonylphenyl)methyl]-1-[(6-ethyl-1,3-benzodioxol-5-yl)methyl]-4-oxo-6-propoxy-quinoline-2-carboxylate CAS Name: 3-[(3-ethoxycarbonylphenyl)methyl]-1-[(6-ethyl-1,3-benzodioxol-5-yl)methyl]-4-oxo-6-propoxy-2-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(3-ethoxycarbonylphenyl)methyl]-1-[(6-ethyl-1,3-benzodioxol-5-yl)methyl]-4-oxo-6-propoxyquinoline-2-carboxylate Traditional Name: 3-(3-carbethoxybenzyl)-1-[(6-ethyl-1,3-benzodioxol-5-yl)methyl]-4-keto-6-propoxy-quinaldic acid ethyl ester Formula: C35H37NO8 MolecularWeight: 599.67018

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC2=C(C=C1)N(C(=C(C2=O)CC3=CC=CC(=C3)C(=O)OCC)C(=O)OCC)CC4=CC5=C(C=C4CC)OCO5

Isomeric SMILES

CCCOC1=CC2=C(C=C1)N(C(=C(C2=O)CC3=CC=CC(=C3)C(=O)OCC)C(=O)OCC)CC4=CC5=C(C=C4CC)OCO5

InChI

InChI=1S/C35H37NO8/c1-5-14-42-26-12-13-29-27(19-26)33(37)28(16-22-10-9-11-24(15-22)34(38)40-7-3)32(35(39)41-8-4)36(29)20-25-18-31-30(43-21-44-31)17-23(25)6-2/h9-13,15,17-19H,5-8,14,16,20-21H2,1-4H3