ethyl 2-(3-chlorophenyl)-9-ethoxy-8-methoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carboxylate

Systemtic Name: ethyl 2-(3-chlorophenyl)-9-ethoxy-8-methoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carboxylate Openeye Name: ethyl 2-(3-chlorophenyl)-9-ethoxy-8-methoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carboxylate CAS Name: 2-(3-chlorophenyl)-9-ethoxy-8-methoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(3-chlorophenyl)-9-ethoxy-8-methoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carboxylate Traditional Name: 2-(3-chlorophenyl)-9-ethoxy-8-methoxy-3-methyl-5,6-dihydropyrrol[2,1-a]isoquinoline-1-carboxylic acid ethyl ester Formula: C25H26ClNO4 MolecularWeight: 439.93124

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2CCN3C(=C(C(=C3C2=C1)C(=O)OCC)C4=CC(=CC=C4)Cl)C)OC

Isomeric SMILES

CCOC1=C(C=C2CCN3C(=C(C(=C3C2=C1)C(=O)OCC)C4=CC(=CC=C4)Cl)C)OC

InChI

InChI=1S/C25H26ClNO4/c1-5-30-21-14-19-16(13-20(21)29-4)10-11-27-15(3)22(17-8-7-9-18(26)12-17)23(24(19)27)25(28)31-6-2/h7-9,12-14H,5-6,10-11H2,1-4H3