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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C(C)NC(=O)CC2=NN(C(=O)C3=CC=CC=C32)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)[C@H](C)NC(=O)CC2=NN(C(=O)C3=CC=CC=C32)C

InChI

InChI=1S/C21H23N3O3/c1-13-9-10-19(27-4)17(11-13)14(2)22-20(25)12-18-15-7-5-6-8-16(15)21(26)24(3)23-18/h5-11,14H,12H2,1-4H3,(H,22,25)/t14-/m0/s1