ethyl 1-(3-chlorophenyl)-2-methyl-5-oxidanyl-4-(pyrrolidin-1-ylmethyl)indole-3-carboxylate

Systemtic Name: ethyl 1-(3-chlorophenyl)-2-methyl-5-oxidanyl-4-(pyrrolidin-1-ylmethyl)indole-3-carboxylate Openeye Name: ethyl 1-(3-chlorophenyl)-5-hydroxy-2-methyl-4-(pyrrolidin-1-ylmethyl)indole-3-carboxylate CAS Name: 1-(3-chlorophenyl)-5-hydroxy-2-methyl-4-(1-pyrrolidinylmethyl)-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-chlorophenyl)-5-hydroxy-2-methyl-4-(pyrrolidin-1-ylmethyl)indole-3-carboxylate Traditional Name: 1-(3-chlorophenyl)-5-hydroxy-2-methyl-4-(pyrrolidinomethyl)indole-3-carboxylic acid ethyl ester Formula: C23H25ClN2O3 MolecularWeight: 412.9092

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C(=C(C=C2)O)CN3CCCC3)C4=CC(=CC=C4)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C(=C(C=C2)O)CN3CCCC3)C4=CC(=CC=C4)Cl)C

InChI

InChI=1S/C23H25ClN2O3/c1-3-29-23(28)21-15(2)26(17-8-6-7-16(24)13-17)19-9-10-20(27)18(22(19)21)14-25-11-4-5-12-25/h6-10,13,27H,3-5,11-12,14H2,1-2H3