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

Systemtic Name: ethyl 2-(3,5-dimethyl-4-oxidanyl-phenyl)-3-ethyl-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carboxylate Openeye Name: ethyl 3-ethyl-2-(4-hydroxy-3,5-dimethyl-phenyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carboxylate CAS Name: 3-ethyl-2-(4-hydroxy-3,5-dimethylphenyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carboxylic acid ethyl ester IUPAC Name: ethyl 3-ethyl-2-(4-hydroxy-3,5-dimethylphenyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carboxylate Traditional Name: 3-ethyl-2-(4-hydroxy-3,5-dimethyl-phenyl)-8,9-dimethoxy-5,6-dihydropyrrol[2,1-a]isoquinoline-1-carboxylic acid ethyl ester Formula: C27H31NO5 MolecularWeight: 449.53874

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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(C(=C4)C)O)C

Isomeric SMILES

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

InChI

InChI=1S/C27H31NO5/c1-7-20-23(18-11-15(3)26(29)16(4)12-18)24(27(30)33-8-2)25-19-14-22(32-6)21(31-5)13-17(19)9-10-28(20)25/h11-14,29H,7-10H2,1-6H3