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

Systemtic Name: ethyl 2-methyl-5-oxidanyl-1-[(4-propan-2-ylphenyl)methyl]benzo[g]indole-3-carboxylate Openeye Name: ethyl 5-hydroxy-1-[(4-isopropylphenyl)methyl]-2-methyl-benzo[g]indole-3-carboxylate CAS Name: 5-hydroxy-2-methyl-1-[(4-propan-2-ylphenyl)methyl]-3-benzo[g]indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-hydroxy-2-methyl-1-[(4-propan-2-ylphenyl)methyl]benzo[g]indole-3-carboxylate Traditional Name: 5-hydroxy-1-(4-isopropylbenzyl)-2-methyl-benz[g]indole-3-carboxylic acid ethyl ester Formula: C26H27NO3 MolecularWeight: 401.49748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C3=CC=CC=C32)O)CC4=CC=C(C=C4)C(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C3=CC=CC=C32)O)CC4=CC=C(C=C4)C(C)C)C

InChI

InChI=1S/C26H27NO3/c1-5-30-26(29)24-17(4)27(15-18-10-12-19(13-11-18)16(2)3)25-21-9-7-6-8-20(21)23(28)14-22(24)25/h6-14,16,28H,5,15H2,1-4H3