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

Systemtic Name: ethyl 1-[2-(4-ethylphenoxy)ethyl]-2-methyl-5-oxidanyl-benzo[g]indole-3-carboxylate Openeye Name: ethyl 1-[2-(4-ethylphenoxy)ethyl]-5-hydroxy-2-methyl-benzo[g]indole-3-carboxylate CAS Name: 1-[2-(4-ethylphenoxy)ethyl]-5-hydroxy-2-methyl-3-benzo[g]indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(4-ethylphenoxy)ethyl]-5-hydroxy-2-methylbenzo[g]indole-3-carboxylate Traditional Name: 1-[2-(4-ethylphenoxy)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:

CCC1=CC=C(C=C1)OCCN2C(=C(C3=C2C4=CC=CC=C4C(=C3)O)C(=O)OCC)C

Isomeric SMILES

CCC1=CC=C(C=C1)OCCN2C(=C(C3=C2C4=CC=CC=C4C(=C3)O)C(=O)OCC)C

InChI

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