ethyl 3-[[[2-(3-methoxyphenyl)-2-oxidanyl-cyclohexyl]methylamino]methyl]-5-methyl-1H-indole-2-carboxylate

Systemtic Name: ethyl 3-[[[2-(3-methoxyphenyl)-2-oxidanyl-cyclohexyl]methylamino]methyl]-5-methyl-1H-indole-2-carboxylate Openeye Name: ethyl 3-[[[2-hydroxy-2-(3-methoxyphenyl)cyclohexyl]methylamino]methyl]-5-methyl-1H-indole-2-carboxylate CAS Name: 3-[[[2-hydroxy-2-(3-methoxyphenyl)cyclohexyl]methylamino]methyl]-5-methyl-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[[[2-hydroxy-2-(3-methoxyphenyl)cyclohexyl]methylamino]methyl]-5-methyl-1H-indole-2-carboxylate Traditional Name: 3-[[[2-hydroxy-2-(3-methoxyphenyl)cyclohexyl]methylamino]methyl]-5-methyl-1H-indole-2-carboxylic acid ethyl ester Formula: C27H34N2O4 MolecularWeight: 450.56986

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)C)CNCC3CCCCC3(C4=CC(=CC=C4)OC)O

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)C)CNCC3CCCCC3(C4=CC(=CC=C4)OC)O

InChI

InChI=1S/C27H34N2O4/c1-4-33-26(30)25-23(22-14-18(2)11-12-24(22)29-25)17-28-16-20-8-5-6-13-27(20,31)19-9-7-10-21(15-19)32-3/h7,9-12,14-15,20,28-29,31H,4-6,8,13,16-17H2,1-3H3