4-methyl-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-3-pyrrol-1-yl-benzamide

Systemtic Name: 4-methyl-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-3-pyrrol-1-yl-benzamide Openeye Name: 4-methyl-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-3-pyrrol-1-yl-benzamide CAS Name: 4-methyl-N-[2-(4-phenyl-1-piperazin-1-iumyl)ethyl]-3-(1-pyrrolyl)benzamide IUPAC Name: 4-methyl-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-3-pyrrol-1-ylbenzamide Traditional Name: 4-methyl-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-3-pyrrol-1-yl-benzamide Formula: C24H29N4O+ MolecularWeight: 389.51326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC[NH+]2CCN(CC2)C3=CC=CC=C3)N4C=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC[NH+]2CCN(CC2)C3=CC=CC=C3)N4C=CC=C4

InChI

InChI=1S/C24H28N4O/c1-20-9-10-21(19-23(20)28-12-5-6-13-28)24(29)25-11-14-26-15-17-27(18-16-26)22-7-3-2-4-8-22/h2-10,12-13,19H,11,14-18H2,1H3,(H,25,29)/p+1