1-[2-[(5-acetamido-2-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-[(5-acetamido-2-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-(5-acetamido-2-methoxy-anilino)-2-oxo-ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[2-(5-acetamido-2-methoxyanilino)-2-oxoethyl]-N-phenyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-(5-acetamido-2-methoxyanilino)-2-oxoethyl]-N-phenylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[2-(5-acetamido-2-methoxy-anilino)-2-keto-ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide Formula: C23H29N4O4+ MolecularWeight: 425.50076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C23H28N4O4/c1-16(28)24-19-8-9-21(31-2)20(14-19)26-22(29)15-27-12-10-17(11-13-27)23(30)25-18-6-4-3-5-7-18/h3-9,14,17H,10-13,15H2,1-2H3,(H,24,28)(H,25,30)(H,26,29)/p+1