3-(3-methoxyphenyl)-4-oxidanylidene-N-(oxolan-2-ylmethyl)phthalazine-1-carboxamide

Systemtic Name: 3-(3-methoxyphenyl)-4-oxidanylidene-N-(oxolan-2-ylmethyl)phthalazine-1-carboxamide Openeye Name: 3-(3-methoxyphenyl)-4-oxo-N-(tetrahydrofuran-2-ylmethyl)phthalazine-1-carboxamide CAS Name: 3-(3-methoxyphenyl)-4-oxo-N-(2-oxolanylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-(3-methoxyphenyl)-4-oxo-N-(oxolan-2-ylmethyl)phthalazine-1-carboxamide Traditional Name: 4-keto-3-(3-methoxyphenyl)-N-(tetrahydrofurfuryl)phthalazine-1-carboxamide Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC4CCCO4

Isomeric SMILES

COC1=CC=CC(=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC4CCCO4

InChI

InChI=1S/C21H21N3O4/c1-27-15-7-4-6-14(12-15)24-21(26)18-10-3-2-9-17(18)19(23-24)20(25)22-13-16-8-5-11-28-16/h2-4,6-7,9-10,12,16H,5,8,11,13H2,1H3,(H,22,25)