N-(2,6-dimethylheptan-4-ylideneamino)-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-(2,6-dimethylheptan-4-ylideneamino)-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[(1-isobutyl-3-methyl-butylidene)amino]-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-(2,6-dimethylheptan-4-ylideneamino)-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-(2,6-dimethylheptan-4-ylideneamino)-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: N-[(1-isobutyl-3-methyl-butylidene)amino]-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C21H30N4O2 MolecularWeight: 370.4885

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=C(CC(C)C)CC(C)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=C(CC(C)C)CC(C)C

InChI

InChI=1S/C21H30N4O2/c1-6-11-25-21(27)18-10-8-7-9-17(18)19(24-25)20(26)23-22-16(12-14(2)3)13-15(4)5/h7-10,14-15H,6,11-13H2,1-5H3,(H,23,26)