N-[(Z)-1-(5-chloranyl-2-methoxy-phenyl)ethylideneamino]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-[(Z)-1-(5-chloranyl-2-methoxy-phenyl)ethylideneamino]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[(Z)-1-(5-chloro-2-methoxy-phenyl)ethylideneamino]-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-[(Z)-1-(5-chloro-2-methoxyphenyl)ethylideneamino]-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-[(Z)-1-(5-chloro-2-methoxyphenyl)ethylideneamino]-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: N-[(Z)-1-(5-chloro-2-methoxy-phenyl)ethylideneamino]-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C21H21ClN4O3 MolecularWeight: 412.86944

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=C(C)C3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C(/C)\C3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C21H21ClN4O3/c1-4-11-26-21(28)16-8-6-5-7-15(16)19(25-26)20(27)24-23-13(2)17-12-14(22)9-10-18(17)29-3/h5-10,12H,4,11H2,1-3H3,(H,24,27)/b23-13-