ethyl 5-[3-[4-(4-chlorophenyl)piperazin-1-yl]propoxy]-1H-indole-2-carboxylate

Systemtic Name: ethyl 5-[3-[4-(4-chlorophenyl)piperazin-1-yl]propoxy]-1H-indole-2-carboxylate Openeye Name: ethyl 5-[3-[4-(4-chlorophenyl)piperazin-1-yl]propoxy]-1H-indole-2-carboxylate CAS Name: 5-[3-[4-(4-chlorophenyl)-1-piperazinyl]propoxy]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[3-[4-(4-chlorophenyl)piperazin-1-yl]propoxy]-1H-indole-2-carboxylate Traditional Name: 5-[3-[4-(4-chlorophenyl)piperazino]propoxy]-1H-indole-2-carboxylic acid ethyl ester Formula: C24H28ClN3O3 MolecularWeight: 441.95042

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(N1)C=CC(=C2)OCCCN3CCN(CC3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC(=O)C1=CC2=C(N1)C=CC(=C2)OCCCN3CCN(CC3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H28ClN3O3/c1-2-30-24(29)23-17-18-16-21(8-9-22(18)26-23)31-15-3-10-27-11-13-28(14-12-27)20-6-4-19(25)5-7-20/h4-9,16-17,26H,2-3,10-15H2,1H3