ethyl 1-[2-(3,4-dimethylphenoxy)ethyl]-2-methyl-5-oxidanyl-benzo[g]indole-3-carboxylate

Systemtic Name: ethyl 1-[2-(3,4-dimethylphenoxy)ethyl]-2-methyl-5-oxidanyl-benzo[g]indole-3-carboxylate Openeye Name: ethyl 1-[2-(3,4-dimethylphenoxy)ethyl]-5-hydroxy-2-methyl-benzo[g]indole-3-carboxylate CAS Name: 1-[2-(3,4-dimethylphenoxy)ethyl]-5-hydroxy-2-methyl-3-benzo[g]indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(3,4-dimethylphenoxy)ethyl]-5-hydroxy-2-methylbenzo[g]indole-3-carboxylate Traditional Name: 1-[2-(3,4-dimethylphenoxy)ethyl]-5-hydroxy-2-methyl-benz[g]indole-3-carboxylic acid ethyl ester Formula: C26H27NO4 MolecularWeight: 417.49688

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C3=CC=CC=C32)O)CCOC4=CC(=C(C=C4)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C3=CC=CC=C32)O)CCOC4=CC(=C(C=C4)C)C)C

InChI

InChI=1S/C26H27NO4/c1-5-30-26(29)24-18(4)27(12-13-31-19-11-10-16(2)17(3)14-19)25-21-9-7-6-8-20(21)23(28)15-22(24)25/h6-11,14-15,28H,5,12-13H2,1-4H3