1-[3-[(3,5-dimethylphenyl)amino]-3-oxidanylidene-propyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[3-[(3,5-dimethylphenyl)amino]-3-oxidanylidene-propyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[3-(3,5-dimethylanilino)-3-oxo-propyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[3-(3,5-dimethylanilino)-3-oxopropyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[3-(3,5-dimethylanilino)-3-oxopropyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[3-(3,5-dimethylanilino)-3-keto-propyl]piperidin-1-ium-4-carboxamide Formula: C17H26N3O2+ MolecularWeight: 304.40724

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25N3O2/c1-12-9-13(2)11-15(10-12)19-16(21)5-8-20-6-3-14(4-7-20)17(18)22/h9-11,14H,3-8H2,1-2H3,(H2,18,22)(H,19,21)/p+1