1-[2-[[2-[(4-ethoxyphenyl)carbamoyl]phenyl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-[[2-[(4-ethoxyphenyl)carbamoyl]phenyl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-[2-[(4-ethoxyphenyl)carbamoyl]anilino]-2-oxo-ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[2-[2-[(4-ethoxyanilino)-oxomethyl]anilino]-2-oxoethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-[2-[(4-ethoxyphenyl)carbamoyl]anilino]-2-oxoethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[2-keto-2-[2-(p-phenetylcarbamoyl)anilino]ethyl]piperidin-1-ium-4-carboxamide Formula: C23H29N4O4+ MolecularWeight: 425.50076

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCC(CC3)C(=O)N

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCC(CC3)C(=O)N

InChI

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