1-[3-[(4-ethanoylphenyl)amino]-3-oxidanylidene-propyl]-N-(phenylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[3-[(4-ethanoylphenyl)amino]-3-oxidanylidene-propyl]-N-(phenylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-[3-(4-acetylanilino)-3-oxo-propyl]-N-benzyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[3-(4-acetylanilino)-3-oxopropyl]-N-(phenylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[3-(4-acetylanilino)-3-oxopropyl]-N-benzylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[3-(4-acetylanilino)-3-keto-propyl]-N-benzyl-piperidin-1-ium-4-carboxamide Formula: C24H30N3O3+ MolecularWeight: 408.5133

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=O)CC[NH+]2CCC(CC2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=O)CC[NH+]2CCC(CC2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C24H29N3O3/c1-18(28)20-7-9-22(10-8-20)26-23(29)13-16-27-14-11-21(12-15-27)24(30)25-17-19-5-3-2-4-6-19/h2-10,21H,11-17H2,1H3,(H,25,30)(H,26,29)/p+1