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

Systemtic Name: ethyl 2-(3,5-dimethyl-4-oxidanyl-phenyl)-8-methoxy-3-methyl-9-nitro-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carboxylate Openeye Name: ethyl 2-(4-hydroxy-3,5-dimethyl-phenyl)-8-methoxy-3-methyl-9-nitro-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carboxylate CAS Name: 2-(4-hydroxy-3,5-dimethylphenyl)-8-methoxy-3-methyl-9-nitro-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-hydroxy-3,5-dimethylphenyl)-8-methoxy-3-methyl-9-nitro-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carboxylate Traditional Name: 2-(4-hydroxy-3,5-dimethyl-phenyl)-8-methoxy-3-methyl-9-nitro-5,6-dihydropyrrol[2,1-a]isoquinoline-1-carboxylic acid ethyl ester Formula: C25H26N2O6 MolecularWeight: 450.48374

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C3=CC(=C(C=C3CCN2C(=C1C4=CC(=C(C(=C4)C)O)C)C)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C2C3=CC(=C(C=C3CCN2C(=C1C4=CC(=C(C(=C4)C)O)C)C)OC)[N+](=O)[O-]

InChI

InChI=1S/C25H26N2O6/c1-6-33-25(29)22-21(17-9-13(2)24(28)14(3)10-17)15(4)26-8-7-16-11-20(32-5)19(27(30)31)12-18(16)23(22)26/h9-12,28H,6-8H2,1-5H3