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

Systemtic Name: ethyl 3-[[[2-(3-hydroxyphenyl)-2-oxidanyl-cyclohexyl]methylamino]methyl]-5-methyl-1H-indole-2-carboxylate Openeye Name: ethyl 3-[[[2-hydroxy-2-(3-hydroxyphenyl)cyclohexyl]methylamino]methyl]-5-methyl-1H-indole-2-carboxylate CAS Name: 3-[[[2-hydroxy-2-(3-hydroxyphenyl)cyclohexyl]methylamino]methyl]-5-methyl-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[[[2-hydroxy-2-(3-hydroxyphenyl)cyclohexyl]methylamino]methyl]-5-methyl-1H-indole-2-carboxylate Traditional Name: 3-[[[2-hydroxy-2-(3-hydroxyphenyl)cyclohexyl]methylamino]methyl]-5-methyl-1H-indole-2-carboxylic acid ethyl ester Formula: C26H32N2O4 MolecularWeight: 436.54328

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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)O)O

Isomeric SMILES

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

InChI

InChI=1S/C26H32N2O4/c1-3-32-25(30)24-22(21-13-17(2)10-11-23(21)28-24)16-27-15-19-7-4-5-12-26(19,31)18-8-6-9-20(29)14-18/h6,8-11,13-14,19,27-29,31H,3-5,7,12,15-16H2,1-2H3