ethyl 3-ethyl-8,9-dimethoxy-2-(4-oxidanylnaphthalen-1-yl)-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carboxylate

Systemtic Name: ethyl 3-ethyl-8,9-dimethoxy-2-(4-oxidanylnaphthalen-1-yl)-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carboxylate Openeye Name: ethyl 3-ethyl-2-(4-hydroxy-1-naphthyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carboxylate CAS Name: 3-ethyl-2-(4-hydroxy-1-naphthalenyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carboxylic acid ethyl ester IUPAC Name: ethyl 3-ethyl-2-(4-hydroxynaphthalen-1-yl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carboxylate Traditional Name: 3-ethyl-2-(4-hydroxy-1-naphthyl)-8,9-dimethoxy-5,6-dihydropyrrol[2,1-a]isoquinoline-1-carboxylic acid ethyl ester Formula: C29H29NO5 MolecularWeight: 471.54426

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2N1CCC3=CC(=C(C=C32)OC)OC)C(=O)OCC)C4=CC=C(C5=CC=CC=C54)O

Isomeric SMILES

CCC1=C(C(=C2N1CCC3=CC(=C(C=C32)OC)OC)C(=O)OCC)C4=CC=C(C5=CC=CC=C54)O

InChI

InChI=1S/C29H29NO5/c1-5-22-26(20-11-12-23(31)19-10-8-7-9-18(19)20)27(29(32)35-6-2)28-21-16-25(34-4)24(33-3)15-17(21)13-14-30(22)28/h7-12,15-16,31H,5-6,13-14H2,1-4H3