ethyl 4,6-bis(chloranyl)-3-[[[2-(3-hydroxyphenyl)-2-oxidanyl-cyclohexyl]methylamino]methyl]-1H-indole-2-carboxylate

Systemtic Name: ethyl 4,6-bis(chloranyl)-3-[[[2-(3-hydroxyphenyl)-2-oxidanyl-cyclohexyl]methylamino]methyl]-1H-indole-2-carboxylate Openeye Name: ethyl 4,6-dichloro-3-[[[2-hydroxy-2-(3-hydroxyphenyl)cyclohexyl]methylamino]methyl]-1H-indole-2-carboxylate CAS Name: 4,6-dichloro-3-[[[2-hydroxy-2-(3-hydroxyphenyl)cyclohexyl]methylamino]methyl]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4,6-dichloro-3-[[[2-hydroxy-2-(3-hydroxyphenyl)cyclohexyl]methylamino]methyl]-1H-indole-2-carboxylate Traditional Name: 4,6-dichloro-3-[[[2-hydroxy-2-(3-hydroxyphenyl)cyclohexyl]methylamino]methyl]-1H-indole-2-carboxylic acid ethyl ester Formula: C25H28Cl2N2O4 MolecularWeight: 491.40682

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=C(C=C2N1)Cl)Cl)CNCC3CCCCC3(C4=CC(=CC=C4)O)O

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=C(C=C2N1)Cl)Cl)CNCC3CCCCC3(C4=CC(=CC=C4)O)O

InChI

InChI=1S/C25H28Cl2N2O4/c1-2-33-24(31)23-19(22-20(27)11-17(26)12-21(22)29-23)14-28-13-16-6-3-4-9-25(16,32)15-7-5-8-18(30)10-15/h5,7-8,10-12,16,28-30,32H,2-4,6,9,13-14H2,1H3