N-[(3S)-3-(4-chlorophenyl)-4-methyl-pentyl]-2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanamide

Systemtic Name: N-[(3S)-3-(4-chlorophenyl)-4-methyl-pentyl]-2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanamide Openeye Name: N-[(3S)-3-(4-chlorophenyl)-4-methyl-pentyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide CAS Name: N-[(3S)-3-(4-chlorophenyl)-4-methylpentyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide IUPAC Name: N-[(3S)-3-(4-chlorophenyl)-4-methylpentyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide Traditional Name: N-[(3S)-3-(4-chlorophenyl)-4-methyl-pentyl]-2-(4-keto-3H-phthalazin-1-yl)acetamide Formula: C22H24ClN3O2 MolecularWeight: 397.89786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCNC(=O)CC1=NNC(=O)C2=CC=CC=C21)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)[C@H](CCNC(=O)CC1=NNC(=O)C2=CC=CC=C21)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H24ClN3O2/c1-14(2)17(15-7-9-16(23)10-8-15)11-12-24-21(27)13-20-18-5-3-4-6-19(18)22(28)26-25-20/h3-10,14,17H,11-13H2,1-2H3,(H,24,27)(H,26,28)/t17-/m0/s1