(2-methoxy-2-phenyl-ethyl) 4-(1,3-benzodioxol-5-yl)-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate

Systemtic Name: (2-methoxy-2-phenyl-ethyl) 4-(1,3-benzodioxol-5-yl)-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate Openeye Name: (2-methoxy-2-phenyl-ethyl) 4-(1,3-benzodioxol-5-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate CAS Name: 4-(1,3-benzodioxol-5-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid (2-methoxy-2-phenylethyl) ester IUPAC Name: (2-methoxy-2-phenylethyl) 4-(1,3-benzodioxol-5-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate Traditional Name: 4-(1,3-benzodioxol-5-yl)-5-keto-2-methyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid (2-methoxy-2-phenyl-ethyl) ester Formula: C27H27NO6 MolecularWeight: 461.50638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)CCCC2=O)C3=CC4=C(C=C3)OCO4)C(=O)OCC(C5=CC=CC=C5)OC

Isomeric SMILES

CC1=C(C(C2=C(N1)CCCC2=O)C3=CC4=C(C=C3)OCO4)C(=O)OCC(C5=CC=CC=C5)OC

InChI

InChI=1S/C27H27NO6/c1-16-24(27(30)32-14-23(31-2)17-7-4-3-5-8-17)25(26-19(28-16)9-6-10-20(26)29)18-11-12-21-22(13-18)34-15-33-21/h3-5,7-8,11-13,23,25,28H,6,9-10,14-15H2,1-2H3