N-[1-[4-(2-methylpropyl)phenyl]ethyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[1-[4-(2-methylpropyl)phenyl]ethyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[1-(4-isobutylphenyl)ethyl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[1-[4-(2-methylpropyl)phenyl]ethyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[1-[4-(2-methylpropyl)phenyl]ethyl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[1-(4-isobutylphenyl)ethyl]-4-keto-3H-phthalazine-1-carboxamide Formula: C21H23N3O2 MolecularWeight: 349.42622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(C)NC(=O)C2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C(C)NC(=O)C2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C21H23N3O2/c1-13(2)12-15-8-10-16(11-9-15)14(3)22-21(26)19-17-6-4-5-7-18(17)20(25)24-23-19/h4-11,13-14H,12H2,1-3H3,(H,22,26)(H,24,25)