N-[4-[(2S)-butan-2-yl]phenyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[4-[(2S)-butan-2-yl]phenyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[4-[(1S)-1-methylpropyl]phenyl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[4-[(2S)-butan-2-yl]phenyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[4-[(2S)-butan-2-yl]phenyl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: 4-keto-N-[4-[(1S)-1-methylpropyl]phenyl]-3H-phthalazine-1-carboxamide Formula: C19H19N3O2 MolecularWeight: 321.37306

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=O)C2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)NC(=O)C2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C19H19N3O2/c1-3-12(2)13-8-10-14(11-9-13)20-19(24)17-15-6-4-5-7-16(15)18(23)22-21-17/h4-12H,3H2,1-2H3,(H,20,24)(H,22,23)/t12-/m0/s1