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

Systemtic Name: N-[1-[2-oxidanylidene-2-[phenyl(propan-2-yl)amino]ethyl]piperidin-1-ium-4-yl]benzamide Openeye Name: N-[1-[2-(N-isopropylanilino)-2-oxo-ethyl]piperidin-1-ium-4-yl]benzamide CAS Name: N-[1-[2-oxo-2-(N-propan-2-ylanilino)ethyl]-4-piperidin-1-iumyl]benzamide IUPAC Name: N-[1-[2-oxo-2-(N-propan-2-ylanilino)ethyl]piperidin-1-ium-4-yl]benzamide Traditional Name: N-[1-[2-(N-isopropylanilino)-2-keto-ethyl]piperidin-1-ium-4-yl]benzamide Formula: C23H30N3O2+ MolecularWeight: 380.5032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC=CC=C1)C(=O)C[NH+]2CCC(CC2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)N(C1=CC=CC=C1)C(=O)C[NH+]2CCC(CC2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H29N3O2/c1-18(2)26(21-11-7-4-8-12-21)22(27)17-25-15-13-20(14-16-25)24-23(28)19-9-5-3-6-10-19/h3-12,18,20H,13-17H2,1-2H3,(H,24,28)/p+1