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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC=CC=C3OC

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC=CC=C3OC

InChI

InChI=1S/C21H23N3O3/c1-3-4-13-24-21(26)17-11-7-6-10-16(17)19(23-24)20(25)22-14-15-9-5-8-12-18(15)27-2/h5-12H,3-4,13-14H2,1-2H3,(H,22,25)