N-[(Z)-[(3R)-3,7-dimethyloct-6-enylidene]amino]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-[(Z)-[(3R)-3,7-dimethyloct-6-enylidene]amino]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[(Z)-[(3R)-3,7-dimethyloct-6-enylidene]amino]-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-[(Z)-[(3R)-3,7-dimethyloct-6-enylidene]amino]-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-[(Z)-[(3R)-3,7-dimethyloct-6-enylidene]amino]-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: N-[(Z)-[(3R)-3,7-dimethyloct-6-enylidene]amino]-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C22H30N4O2 MolecularWeight: 382.4992

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C\C[C@H](C)CCC=C(C)C

InChI

InChI=1S/C22H30N4O2/c1-5-15-26-22(28)19-12-7-6-11-18(19)20(25-26)21(27)24-23-14-13-17(4)10-8-9-16(2)3/h6-7,9,11-12,14,17H,5,8,10,13,15H2,1-4H3,(H,24,27)/b23-14-/t17-/m1/s1