3-(4-methoxyphenyl)-5-[(4-methoxyphenyl)carbamoyl]-1-(2-piperidin-1-ylethyl)-1,2,3-triazol-1-ium-4-olate

Systemtic Name: 3-(4-methoxyphenyl)-5-[(4-methoxyphenyl)carbamoyl]-1-(2-piperidin-1-ylethyl)-1,2,3-triazol-1-ium-4-olate Openeye Name: 3-(4-methoxyphenyl)-5-[(4-methoxyphenyl)carbamoyl]-1-[2-(1-piperidyl)ethyl]triazol-1-ium-4-olate CAS Name: 5-[(4-methoxyanilino)-oxomethyl]-3-(4-methoxyphenyl)-1-[2-(1-piperidinyl)ethyl]-4-triazol-1-iumolate IUPAC Name: 3-(4-methoxyphenyl)-5-[(4-methoxyphenyl)carbamoyl]-1-(2-piperidin-1-ylethyl)triazol-1-ium-4-olate Traditional Name: 3-(4-methoxyphenyl)-5-[(4-methoxyphenyl)carbamoyl]-1-(2-piperidinoethyl)triazol-1-ium-4-olate Formula: C24H29N5O4 MolecularWeight: 451.51816

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=C(N(N=[N+]2CCN3CCCCC3)C4=CC=C(C=C4)OC)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=C(N(N=[N+]2CCN3CCCCC3)C4=CC=C(C=C4)OC)[O-]

InChI

InChI=1S/C24H29N5O4/c1-32-20-10-6-18(7-11-20)25-23(30)22-24(31)29(19-8-12-21(33-2)13-9-19)26-28(22)17-16-27-14-4-3-5-15-27/h6-13H,3-5,14-17H2,1-2H3,(H-,25,26,30,31)