N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-3-pyrrol-1-yl-benzamide

Systemtic Name: N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-3-pyrrol-1-yl-benzamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-pyrrol-1-yl-benzamide CAS Name: N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-3-(1-pyrrolyl)benzamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-pyrrol-1-ylbenzamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-pyrrol-1-yl-benzamide Formula: C23H26N3O+ MolecularWeight: 360.47204

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)C2=CC(=CC=C2)N3C=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1NC(=O)C2=CC(=CC=C2)N3C=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C23H25N3O/c27-23(20-9-6-10-22(17-20)26-13-4-5-14-26)24-21-11-15-25(16-12-21)18-19-7-2-1-3-8-19/h1-10,13-14,17,21H,11-12,15-16,18H2,(H,24,27)/p+1