1-(4-butoxyphenyl)sulfonyl-4-piperazin-1-yl-indole

Systemtic Name: 1-(4-butoxyphenyl)sulfonyl-4-piperazin-1-yl-indole Openeye Name: 1-(4-butoxyphenyl)sulfonyl-4-piperazin-1-yl-indole CAS Name: 1-(4-butoxyphenyl)sulfonyl-4-(1-piperazinyl)indole IUPAC Name: 1-(4-butoxyphenyl)sulfonyl-4-piperazin-1-ylindole Traditional Name: 1-(4-butoxyphenyl)sulfonyl-4-piperazino-indole Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2C=CC3=C2C=CC=C3N4CCNCC4

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2C=CC3=C2C=CC=C3N4CCNCC4

InChI

InChI=1S/C22H27N3O3S/c1-2-3-17-28-18-7-9-19(10-8-18)29(26,27)25-14-11-20-21(5-4-6-22(20)25)24-15-12-23-13-16-24/h4-11,14,23H,2-3,12-13,15-17H2,1H3