[4-(4-methoxyphenyl)piperazin-1-yl]-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methanone

Systemtic Name: [4-(4-methoxyphenyl)piperazin-1-yl]-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methanone Openeye Name: [4-(4-methoxyphenyl)piperazin-1-yl]-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methanone CAS Name: [4-(4-methoxyphenyl)-1-piperazinyl]-[4-(1-pyrrolidin-1-iumylmethyl)phenyl]methanone IUPAC Name: [4-(4-methoxyphenyl)piperazin-1-yl]-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methanone Traditional Name: [4-(4-methoxyphenyl)piperazino]-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methanone Formula: C23H30N3O2+ MolecularWeight: 380.5032

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C[NH+]4CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C[NH+]4CCCC4

InChI

InChI=1S/C23H29N3O2/c1-28-22-10-8-21(9-11-22)25-14-16-26(17-15-25)23(27)20-6-4-19(5-7-20)18-24-12-2-3-13-24/h4-11H,2-3,12-18H2,1H3/p+1