N-[(Z)-[(3S)-3,7-dimethyloct-6-enylidene]amino]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide

Systemtic Name: N-[(Z)-[(3S)-3,7-dimethyloct-6-enylidene]amino]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide Openeye Name: N-[(Z)-[(3S)-3,7-dimethyloct-6-enylidene]amino]-3-isopropyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(Z)-[(3S)-3,7-dimethyloct-6-enylidene]amino]-4-oxo-3-propan-2-yl-1-phthalazinecarboxamide IUPAC Name: N-[(Z)-[(3S)-3,7-dimethyloct-6-enylidene]amino]-4-oxo-3-propan-2-ylphthalazine-1-carboxamide Traditional Name: N-[(Z)-[(3S)-3,7-dimethyloct-6-enylidene]amino]-3-isopropyl-4-keto-phthalazine-1-carboxamide Formula: C22H30N4O2 MolecularWeight: 382.4992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=CCC(C)CCC=C(C)C

Isomeric SMILES

C[C@@H](CCC=C(C)C)C/C=N\NC(=O)C1=NN(C(=O)C2=CC=CC=C21)C(C)C

InChI

InChI=1S/C22H30N4O2/c1-15(2)9-8-10-17(5)13-14-23-24-21(27)20-18-11-6-7-12-19(18)22(28)26(25-20)16(3)4/h6-7,9,11-12,14,16-17H,8,10,13H2,1-5H3,(H,24,27)/b23-14-/t17-/m0/s1