methyl 1-[2-[[4-[(4-methoxyphenyl)carbamoyl]phenyl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate

Systemtic Name: methyl 1-[2-[[4-[(4-methoxyphenyl)carbamoyl]phenyl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate Openeye Name: methyl 1-[2-[4-[(4-methoxyphenyl)carbamoyl]anilino]-2-oxo-ethyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[2-[4-[(4-methoxyanilino)-oxomethyl]anilino]-2-oxoethyl]-4-piperidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[4-[(4-methoxyphenyl)carbamoyl]anilino]-2-oxoethyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[2-keto-2-[4-[(4-methoxyphenyl)carbamoyl]anilino]ethyl]piperidin-1-ium-4-carboxylic acid methyl ester Formula: C23H28N3O5+ MolecularWeight: 426.48552

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C[NH+]3CCC(CC3)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C[NH+]3CCC(CC3)C(=O)OC

InChI

InChI=1S/C23H27N3O5/c1-30-20-9-7-19(8-10-20)25-22(28)16-3-5-18(6-4-16)24-21(27)15-26-13-11-17(12-14-26)23(29)31-2/h3-10,17H,11-15H2,1-2H3,(H,24,27)(H,25,28)/p+1