[2-[(2-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium

Systemtic Name: [2-[(2-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium Openeye Name: (1-benzylpiperidin-1-ium-4-yl)-[2-(2-methoxyanilino)-2-oxo-ethyl]ammonium CAS Name: [2-(2-methoxyanilino)-2-oxoethyl]-[1-(phenylmethyl)-4-piperidin-1-iumyl]ammonium IUPAC Name: (1-benzylpiperidin-1-ium-4-yl)-[2-(2-methoxyanilino)-2-oxoethyl]azanium Traditional Name: (1-benzylpiperidin-1-ium-4-yl)-[2-keto-2-(o-anisidino)ethyl]ammonium Formula: C21H29N3O2+2 MolecularWeight: 355.47386

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C[NH2+]C2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C[NH2+]C2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H27N3O2/c1-26-20-10-6-5-9-19(20)23-21(25)15-22-18-11-13-24(14-12-18)16-17-7-3-2-4-8-17/h2-10,18,22H,11-16H2,1H3,(H,23,25)/p+2