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

Systemtic Name: N-[1-[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]-2-phenyl-ethanamide Openeye Name: N-[1-[2-(3,4-dimethylanilino)-2-oxo-ethyl]piperidin-1-ium-4-yl]-2-phenyl-acetamide CAS Name: N-[1-[2-(3,4-dimethylanilino)-2-oxoethyl]-4-piperidin-1-iumyl]-2-phenylacetamide IUPAC Name: N-[1-[2-(3,4-dimethylanilino)-2-oxoethyl]piperidin-1-ium-4-yl]-2-phenylacetamide Traditional Name: N-[1-[2-(3,4-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=C(C=C(C=C1)NC(=O)C[NH+]2CCC(CC2)NC(=O)CC3=CC=CC=C3)C

Isomeric SMILES

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

InChI

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