4-piperazin-1-yl-1-(4-propoxyphenyl)sulfonyl-indole hydrochloride

Systemtic Name: 4-piperazin-1-yl-1-(4-propoxyphenyl)sulfonyl-indole hydrochloride Openeye Name: 4-piperazin-1-yl-1-(4-propoxyphenyl)sulfonyl-indole hydrochloride CAS Name: 4-(1-piperazinyl)-1-(4-propoxyphenyl)sulfonylindole hydrochloride IUPAC Name: 4-piperazin-1-yl-1-(4-propoxyphenyl)sulfonylindole hydrochloride Traditional Name: 4-piperazino-1-(4-propoxyphenyl)sulfonyl-indole hydrochloride Formula: C21H26ClN3O3S MolecularWeight: 435.96744

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)S(=O)(=O)N2C=CC3=C2C=CC=C3N4CCNCC4.Cl

Isomeric SMILES

CCCOC1=CC=C(C=C1)S(=O)(=O)N2C=CC3=C2C=CC=C3N4CCNCC4.Cl

InChI

InChI=1S/C21H25N3O3S.ClH/c1-2-16-27-17-6-8-18(9-7-17)28(25,26)24-13-10-19-20(4-3-5-21(19)24)23-14-11-22-12-15-23;/h3-10,13,22H,2,11-12,14-16H2,1H3;1H