N-[(2-methoxyphenyl)methyl]-3-(3-methylbutyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[(2-methoxyphenyl)methyl]-3-(3-methylbutyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-isopentyl-N-[(2-methoxyphenyl)methyl]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(2-methoxyphenyl)methyl]-3-(3-methylbutyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[(2-methoxyphenyl)methyl]-3-(3-methylbutyl)-4-oxophthalazine-1-carboxamide Traditional Name: 3-isoamyl-4-keto-N-o-anisyl-phthalazine-1-carboxamide Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC=CC=C3OC

Isomeric SMILES

CC(C)CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC=CC=C3OC

InChI

InChI=1S/C22H25N3O3/c1-15(2)12-13-25-22(27)18-10-6-5-9-17(18)20(24-25)21(26)23-14-16-8-4-7-11-19(16)28-3/h4-11,15H,12-14H2,1-3H3,(H,23,26)