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2-(4-chlorophenyl)-3-cyclohexyl-1-(2-oxidanylidene-2-piperazin-1-yl-ethyl)indole-6-carboxylic acid

2-(4-chlorophenyl)-3-cyclohexyl-1-(2-oxidanylidene-2-piperazin-1-yl-ethyl)indole-6-carboxylic acid

Systemtic Name:2-(4-chlorophenyl)-3-cyclohexyl-1-(2-oxidanylidene-2-piperazin-1-yl-ethyl)indole-6-carboxylic acid
Openeye Name:2-(4-chlorophenyl)-3-cyclohexyl-1-(2-oxo-2-piperazin-1-yl-ethyl)indole-6-carboxylic acid
CAS Name:2-(4-chlorophenyl)-3-cyclohexyl-1-[2-oxo-2-(1-piperazinyl)ethyl]-6-indolecarboxylic acid
IUPAC Name:2-(4-chlorophenyl)-3-cyclohexyl-1-(2-oxo-2-piperazin-1-ylethyl)indole-6-carboxylic acid
Traditional Name:2-(4-chlorophenyl)-3-cyclohexyl-1-(2-keto-2-piperazino-ethyl)indole-6-carboxylic acid
Formula: C27H30ClN3O3
MolecularWeight: 479.9984
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(N(C3=C2C=CC(=C3)C(=O)O)CC(=O)N4CCNCC4)C5=CC=C(C=C5)Cl


Isomeric SMILES

C1CCC(CC1)C2=C(N(C3=C2C=CC(=C3)C(=O)O)CC(=O)N4CCNCC4)C5=CC=C(C=C5)Cl


InChI

InChI=1S/C27H30ClN3O3/c28-21-9-6-19(7-10-21)26-25(18-4-2-1-3-5-18)22-11-8-20(27(33)34)16-23(22)31(26)17-24(32)30-14-12-29-13-15-30/h6-11,16,18,29H,1-5,12-15,17H2,(H,33,34)


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