1-[[4-[(4-methoxyphenyl)carbamoyl]phenyl]methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[[4-[(4-methoxyphenyl)carbamoyl]phenyl]methyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[[4-[(4-methoxyphenyl)carbamoyl]phenyl]methyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[[4-[(4-methoxyanilino)-oxomethyl]phenyl]methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[[4-[(4-methoxyphenyl)carbamoyl]phenyl]methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[4-[(4-methoxyphenyl)carbamoyl]benzyl]piperidin-1-ium-4-carboxamide Formula: C21H26N3O3+ MolecularWeight: 368.44944

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O3/c1-27-19-8-6-18(7-9-19)23-21(26)17-4-2-15(3-5-17)14-24-12-10-16(11-13-24)20(22)25/h2-9,16H,10-14H2,1H3,(H2,22,25)(H,23,26)/p+1