6,7-dimethyl-4-oxidanylidene-N-[2-(1,2,4-triazol-1-yl)propyl]chromene-2-carboxamide

Systemtic Name: 6,7-dimethyl-4-oxidanylidene-N-[2-(1,2,4-triazol-1-yl)propyl]chromene-2-carboxamide Openeye Name: 6,7-dimethyl-4-oxo-N-[2-(1,2,4-triazol-1-yl)propyl]chromene-2-carboxamide CAS Name: 6,7-dimethyl-4-oxo-N-[2-(1,2,4-triazol-1-yl)propyl]-1-benzopyran-2-carboxamide IUPAC Name: 6,7-dimethyl-4-oxo-N-[2-(1,2,4-triazol-1-yl)propyl]chromene-2-carboxamide Traditional Name: 4-keto-6,7-dimethyl-N-[2-(1,2,4-triazol-1-yl)propyl]chromene-2-carboxamide Formula: C17H18N4O3 MolecularWeight: 326.34982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=O)C=C(O2)C(=O)NCC(C)N3C=NC=N3)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=O)C=C(O2)C(=O)NCC(C)N3C=NC=N3)C

InChI

InChI=1S/C17H18N4O3/c1-10-4-13-14(22)6-16(24-15(13)5-11(10)2)17(23)19-7-12(3)21-9-18-8-20-21/h4-6,8-9,12H,7H2,1-3H3,(H,19,23)