3-methyl-N-[(1R)-2-methyl-1-(4-propylphenyl)propyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-methyl-N-[(1R)-2-methyl-1-(4-propylphenyl)propyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-methyl-N-[(1R)-2-methyl-1-(4-propylphenyl)propyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-methyl-N-[(1R)-2-methyl-1-(4-propylphenyl)propyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-methyl-N-[(1R)-2-methyl-1-(4-propylphenyl)propyl]-4-oxophthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-[(1R)-2-methyl-1-(4-propylphenyl)propyl]phthalazine-1-carboxamide Formula: C23H27N3O2 MolecularWeight: 377.47938

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(C(C)C)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C

Isomeric SMILES

CCCC1=CC=C(C=C1)[C@@H](C(C)C)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C

InChI

InChI=1S/C23H27N3O2/c1-5-8-16-11-13-17(14-12-16)20(15(2)3)24-22(27)21-18-9-6-7-10-19(18)23(28)26(4)25-21/h6-7,9-15,20H,5,8H2,1-4H3,(H,24,27)/t20-/m1/s1