N-[[2-methoxy-5-(3-methyl-4-oxidanylidene-phthalazin-1-yl)phenyl]methyl]butanamide

Systemtic Name: N-[[2-methoxy-5-(3-methyl-4-oxidanylidene-phthalazin-1-yl)phenyl]methyl]butanamide Openeye Name: N-[[2-methoxy-5-(3-methyl-4-oxo-phthalazin-1-yl)phenyl]methyl]butanamide CAS Name: N-[[2-methoxy-5-(3-methyl-4-oxo-1-phthalazinyl)phenyl]methyl]butanamide IUPAC Name: N-[[2-methoxy-5-(3-methyl-4-oxophthalazin-1-yl)phenyl]methyl]butanamide Traditional Name: N-[5-(4-keto-3-methyl-phthalazin-1-yl)-2-methoxy-benzyl]butyramide Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NCC1=C(C=CC(=C1)C2=NN(C(=O)C3=CC=CC=C32)C)OC

Isomeric SMILES

CCCC(=O)NCC1=C(C=CC(=C1)C2=NN(C(=O)C3=CC=CC=C32)C)OC

InChI

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