4-[[4-(azepan-1-ylcarbonyl)piperidin-1-ium-1-yl]methyl]benzamide

Systemtic Name: 4-[[4-(azepan-1-ylcarbonyl)piperidin-1-ium-1-yl]methyl]benzamide Openeye Name: 4-[[4-(azepane-1-carbonyl)piperidin-1-ium-1-yl]methyl]benzamide CAS Name: 4-[[4-[1-azepanyl(oxo)methyl]-1-piperidin-1-iumyl]methyl]benzamide IUPAC Name: 4-[[4-(azepane-1-carbonyl)piperidin-1-ium-1-yl]methyl]benzamide Traditional Name: 4-[[4-(azepane-1-carbonyl)piperidin-1-ium-1-yl]methyl]benzamide Formula: C20H30N3O2+ MolecularWeight: 344.4711

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CC[NH+](CC2)CC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CC[NH+](CC2)CC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C20H29N3O2/c21-19(24)17-7-5-16(6-8-17)15-22-13-9-18(10-14-22)20(25)23-11-3-1-2-4-12-23/h5-8,18H,1-4,9-15H2,(H2,21,24)/p+1