N-[1-[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]-2-phenyl-ethanamide

Systemtic Name: N-[1-[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]-2-phenyl-ethanamide Openeye Name: N-[1-[2-(3,5-dimethylanilino)-2-oxo-ethyl]piperidin-1-ium-4-yl]-2-phenyl-acetamide CAS Name: N-[1-[2-(3,5-dimethylanilino)-2-oxoethyl]-4-piperidin-1-iumyl]-2-phenylacetamide IUPAC Name: N-[1-[2-(3,5-dimethylanilino)-2-oxoethyl]piperidin-1-ium-4-yl]-2-phenylacetamide Traditional Name: N-[1-[2-(3,5-dimethylanilino)-2-keto-ethyl]piperidin-1-ium-4-yl]-2-phenyl-acetamide Formula: C23H30N3O2+ MolecularWeight: 380.5032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)C[NH+]2CCC(CC2)NC(=O)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)C[NH+]2CCC(CC2)NC(=O)CC3=CC=CC=C3)C

InChI

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