N-(phenylmethyl)-3-piperazin-4-ium-1-yl-benzamide

Systemtic Name: N-(phenylmethyl)-3-piperazin-4-ium-1-yl-benzamide Openeye Name: N-benzyl-3-piperazin-4-ium-1-yl-benzamide CAS Name: N-(phenylmethyl)-3-(1-piperazin-4-iumyl)benzamide IUPAC Name: N-benzyl-3-piperazin-4-ium-1-ylbenzamide Traditional Name: N-benzyl-3-piperazin-4-ium-1-yl-benzamide Formula: C18H22N3O+ MolecularWeight: 296.38678

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=CC=CC(=C2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH2+]1)C2=CC=CC(=C2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C18H21N3O/c22-18(20-14-15-5-2-1-3-6-15)16-7-4-8-17(13-16)21-11-9-19-10-12-21/h1-8,13,19H,9-12,14H2,(H,20,22)/p+1