1-oxidanylidene-3-phenyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]-3,4-dihydroisochromene-6-carboxamide

Systemtic Name: 1-oxidanylidene-3-phenyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]-3,4-dihydroisochromene-6-carboxamide Openeye Name: 1-oxo-3-phenyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]isochromane-6-carboxamide CAS Name: 1-oxo-3-phenyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]-3,4-dihydro-1H-2-benzopyran-6-carboxamide IUPAC Name: 1-oxo-3-phenyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]-3,4-dihydroisochromene-6-carboxamide Traditional Name: 1-keto-3-phenyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]isochroman-6-carboxamide Formula: C26H22N4O3 MolecularWeight: 438.47788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=NC=N2)NC(=O)C3=CC4=C(C=C3)C(=O)OC(C4)C5=CC=CC=C5

Isomeric SMILES

CC(C1=CC=C(C=C1)N2C=NC=N2)NC(=O)C3=CC4=C(C=C3)C(=O)OC(C4)C5=CC=CC=C5

InChI

InChI=1S/C26H22N4O3/c1-17(18-7-10-22(11-8-18)30-16-27-15-28-30)29-25(31)20-9-12-23-21(13-20)14-24(33-26(23)32)19-5-3-2-4-6-19/h2-13,15-17,24H,14H2,1H3,(H,29,31)