1-[3-[(3-methylphenyl)amino]-3-oxidanylidene-propyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[3-[(3-methylphenyl)amino]-3-oxidanylidene-propyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[3-(3-methylanilino)-3-oxo-propyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[3-(3-methylanilino)-3-oxopropyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[3-(3-methylanilino)-3-oxopropyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[3-keto-3-(m-toluidino)propyl]piperidin-1-ium-4-carboxamide Formula: C16H24N3O2+ MolecularWeight: 290.38066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O2/c1-12-3-2-4-14(11-12)18-15(20)7-10-19-8-5-13(6-9-19)16(17)21/h2-4,11,13H,5-10H2,1H3,(H2,17,21)(H,18,20)/p+1