1-[4-[3-(1-phenylpiperazin-1-ium-1-yl)propoxy]phenyl]sulfonyl-2-propan-2-yl-indolizine

Systemtic Name: 1-[4-[3-(1-phenylpiperazin-1-ium-1-yl)propoxy]phenyl]sulfonyl-2-propan-2-yl-indolizine Openeye Name: 2-isopropyl-1-[4-[3-(1-phenylpiperazin-1-ium-1-yl)propoxy]phenyl]sulfonyl-indolizine CAS Name: 1-[4-[3-(1-phenyl-1-piperazin-1-iumyl)propoxy]phenyl]sulfonyl-2-propan-2-ylindolizine IUPAC Name: 1-[4-[3-(1-phenylpiperazin-1-ium-1-yl)propoxy]phenyl]sulfonyl-2-propan-2-ylindolizine Traditional Name: 2-isopropyl-1-[4-[3-(1-phenylpiperazin-1-ium-1-yl)propoxy]phenyl]sulfonyl-indolizine Formula: C30H36N3O3S+ MolecularWeight: 518.69014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CN2C=CC=CC2=C1S(=O)(=O)C3=CC=C(C=C3)OCCC[N+]4(CCNCC4)C5=CC=CC=C5

Isomeric SMILES

CC(C)C1=CN2C=CC=CC2=C1S(=O)(=O)C3=CC=C(C=C3)OCCC[N+]4(CCNCC4)C5=CC=CC=C5

InChI

InChI=1S/C30H36N3O3S/c1-24(2)28-23-32-18-7-6-11-29(32)30(28)37(34,35)27-14-12-26(13-15-27)36-22-8-19-33(20-16-31-17-21-33)25-9-4-3-5-10-25/h3-7,9-15,18,23-24,31H,8,16-17,19-22H2,1-2H3/q+1