ethyl 1-[(3,4-dichlorophenyl)methyl]-4-(dimethylaminomethyl)-5-oxidanyl-indole-2-carboxylate

Systemtic Name: ethyl 1-[(3,4-dichlorophenyl)methyl]-4-(dimethylaminomethyl)-5-oxidanyl-indole-2-carboxylate Openeye Name: ethyl 1-[(3,4-dichlorophenyl)methyl]-4-(dimethylaminomethyl)-5-hydroxy-indole-2-carboxylate CAS Name: 1-[(3,4-dichlorophenyl)methyl]-4-(dimethylaminomethyl)-5-hydroxy-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(3,4-dichlorophenyl)methyl]-4-(dimethylaminomethyl)-5-hydroxyindole-2-carboxylate Traditional Name: 1-(3,4-dichlorobenzyl)-4-(dimethylaminomethyl)-5-hydroxy-indole-2-carboxylic acid ethyl ester Formula: C21H22Cl2N2O3 MolecularWeight: 421.31698

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(N1CC3=CC(=C(C=C3)Cl)Cl)C=CC(=C2CN(C)C)O

Isomeric SMILES

CCOC(=O)C1=CC2=C(N1CC3=CC(=C(C=C3)Cl)Cl)C=CC(=C2CN(C)C)O

InChI

InChI=1S/C21H22Cl2N2O3/c1-4-28-21(27)19-10-14-15(12-24(2)3)20(26)8-7-18(14)25(19)11-13-5-6-16(22)17(23)9-13/h5-10,26H,4,11-12H2,1-3H3