1-[(2-chlorophenyl)methyl]-N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-[(2-chlorophenyl)methyl]-N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-[(2-chlorophenyl)methyl]-N-(isochroman-1-ylmethyl)triazole-4-carboxamide CAS Name: 1-[(2-chlorophenyl)methyl]-N-(3,4-dihydro-1H-2-benzopyran-1-ylmethyl)-4-triazolecarboxamide IUPAC Name: 1-[(2-chlorophenyl)methyl]-N-(3,4-dihydro-1H-isochromen-1-ylmethyl)triazole-4-carboxamide Traditional Name: 1-(2-chlorobenzyl)-N-(isochroman-1-ylmethyl)triazole-4-carboxamide Formula: C20H19ClN4O2 MolecularWeight: 382.84346

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(C2=CC=CC=C21)CNC(=O)C3=CN(N=N3)CC4=CC=CC=C4Cl

Isomeric SMILES

C1COC(C2=CC=CC=C21)CNC(=O)C3=CN(N=N3)CC4=CC=CC=C4Cl

InChI

InChI=1S/C20H19ClN4O2/c21-17-8-4-2-6-15(17)12-25-13-18(23-24-25)20(26)22-11-19-16-7-3-1-5-14(16)9-10-27-19/h1-8,13,19H,9-12H2,(H,22,26)