4-[(3S)-3-methylpiperidin-1-yl]carbonyl-2-phenyl-phthalazin-1-one

Systemtic Name: 4-[(3S)-3-methylpiperidin-1-yl]carbonyl-2-phenyl-phthalazin-1-one Openeye Name: 4-[(3S)-3-methylpiperidine-1-carbonyl]-2-phenyl-phthalazin-1-one CAS Name: 4-[[(3S)-3-methyl-1-piperidinyl]-oxomethyl]-2-phenyl-1-phthalazinone IUPAC Name: 4-[(3S)-3-methylpiperidine-1-carbonyl]-2-phenylphthalazin-1-one Traditional Name: 4-[(3S)-3-methylpiperidine-1-carbonyl]-2-phenyl-phthalazin-1-one Formula: C21H21N3O2 MolecularWeight: 347.41034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

C[C@H]1CCCN(C1)C(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C21H21N3O2/c1-15-8-7-13-23(14-15)21(26)19-17-11-5-6-12-18(17)20(25)24(22-19)16-9-3-2-4-10-16/h2-6,9-12,15H,7-8,13-14H2,1H3/t15-/m0/s1