N-[2-oxidanylidene-2-[[1-(phenylmethyl)piperidin-1-ium-4-yl]amino]ethyl]-4-phenyl-benzamide

Systemtic Name: N-[2-oxidanylidene-2-[[1-(phenylmethyl)piperidin-1-ium-4-yl]amino]ethyl]-4-phenyl-benzamide Openeye Name: N-[2-[(1-benzylpiperidin-1-ium-4-yl)amino]-2-oxo-ethyl]-4-phenyl-benzamide CAS Name: N-[2-oxo-2-[[1-(phenylmethyl)-4-piperidin-1-iumyl]amino]ethyl]-4-phenylbenzamide IUPAC Name: N-[2-[(1-benzylpiperidin-1-ium-4-yl)amino]-2-oxoethyl]-4-phenylbenzamide Traditional Name: N-[2-[(1-benzylpiperidin-1-ium-4-yl)amino]-2-keto-ethyl]-4-phenyl-benzamide Formula: C27H30N3O2+ MolecularWeight: 428.546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H29N3O2/c31-26(29-25-15-17-30(18-16-25)20-21-7-3-1-4-8-21)19-28-27(32)24-13-11-23(12-14-24)22-9-5-2-6-10-22/h1-14,25H,15-20H2,(H,28,32)(H,29,31)/p+1