5-(2-chloranylethanoylamino)-N,1-bis(phenylmethyl)-2H-1,2,3-triazol-1-ium-4-carboxamide

Systemtic Name: 5-(2-chloranylethanoylamino)-N,1-bis(phenylmethyl)-2H-1,2,3-triazol-1-ium-4-carboxamide Openeye Name: N,1-dibenzyl-5-[(2-chloroacetyl)amino]-2H-triazol-1-ium-4-carboxamide CAS Name: 5-[(2-chloro-1-oxoethyl)amino]-N,1-bis(phenylmethyl)-2H-triazol-1-ium-4-carboxamide IUPAC Name: N,1-dibenzyl-5-[(2-chloroacetyl)amino]-2H-triazol-1-ium-4-carboxamide Traditional Name: N,1-dibenzyl-5-[(2-chloroacetyl)amino]-2H-triazol-1-ium-4-carboxamide Formula: C19H19ClN5O2+ MolecularWeight: 384.83946

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=NN[N+](=C2NC(=O)CCl)CC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=NN[N+](=C2NC(=O)CCl)CC3=CC=CC=C3

InChI

InChI=1S/C19H18ClN5O2/c20-11-16(26)22-18-17(19(27)21-12-14-7-3-1-4-8-14)23-24-25(18)13-15-9-5-2-6-10-15/h1-10H,11-13H2,(H2,21,22,24,26,27)/p+1