methyl 2-(3,5-dimethyl-4-oxidanyl-phenyl)-8,9-dimethoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carboxylate

Systemtic Name: methyl 2-(3,5-dimethyl-4-oxidanyl-phenyl)-8,9-dimethoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carboxylate Openeye Name: methyl 2-(4-hydroxy-3,5-dimethyl-phenyl)-8,9-dimethoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carboxylate CAS Name: 2-(4-hydroxy-3,5-dimethylphenyl)-8,9-dimethoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carboxylic acid methyl ester IUPAC Name: methyl 2-(4-hydroxy-3,5-dimethylphenyl)-8,9-dimethoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carboxylate Traditional Name: 2-(4-hydroxy-3,5-dimethyl-phenyl)-8,9-dimethoxy-3-methyl-5,6-dihydropyrrol[2,1-a]isoquinoline-1-carboxylic acid methyl ester Formula: C25H27NO5 MolecularWeight: 421.48558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)C2=C(N3CCC4=CC(=C(C=C4C3=C2C(=O)OC)OC)OC)C

Isomeric SMILES

CC1=CC(=CC(=C1O)C)C2=C(N3CCC4=CC(=C(C=C4C3=C2C(=O)OC)OC)OC)C

InChI

InChI=1S/C25H27NO5/c1-13-9-17(10-14(2)24(13)27)21-15(3)26-8-7-16-11-19(29-4)20(30-5)12-18(16)23(26)22(21)25(28)31-6/h9-12,27H,7-8H2,1-6H3