N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-(2,3-dihydrobenzofuran-2-ylmethyl)-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-(2,3-dihydrobenzofuran-2-ylmethyl)-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: N-(coumaran-2-ylmethyl)-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3CC4=CC=CC=C4O3

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3CC4=CC=CC=C4O3

InChI

InChI=1S/C21H21N3O3/c1-2-11-24-21(26)17-9-5-4-8-16(17)19(23-24)20(25)22-13-15-12-14-7-3-6-10-18(14)27-15/h3-10,15H,2,11-13H2,1H3,(H,22,25)