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

Systemtic Name: N-[(2-methoxyphenyl)methyl]-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-isobutyl-N-[(2-methoxyphenyl)methyl]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(2-methoxyphenyl)methyl]-3-(2-methylpropyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[(2-methoxyphenyl)methyl]-3-(2-methylpropyl)-4-oxophthalazine-1-carboxamide Traditional Name: 3-isobutyl-4-keto-N-o-anisyl-phthalazine-1-carboxamide Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC=CC=C3OC

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC=CC=C3OC

InChI

InChI=1S/C21H23N3O3/c1-14(2)13-24-21(26)17-10-6-5-9-16(17)19(23-24)20(25)22-12-15-8-4-7-11-18(15)27-3/h4-11,14H,12-13H2,1-3H3,(H,22,25)