N-[3-chloranyl-4-(2-methylpropoxy)phenyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[3-chloranyl-4-(2-methylpropoxy)phenyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-(3-chloro-4-isobutoxy-phenyl)-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[3-chloro-4-(2-methylpropoxy)phenyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[3-chloro-4-(2-methylpropoxy)phenyl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-(3-chloro-4-isobutoxy-phenyl)-4-keto-3H-phthalazine-1-carboxamide Formula: C19H18ClN3O3 MolecularWeight: 371.81752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)NC(=O)C2=NNC(=O)C3=CC=CC=C32)Cl

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)NC(=O)C2=NNC(=O)C3=CC=CC=C32)Cl

InChI

InChI=1S/C19H18ClN3O3/c1-11(2)10-26-16-8-7-12(9-15(16)20)21-19(25)17-13-5-3-4-6-14(13)18(24)23-22-17/h3-9,11H,10H2,1-2H3,(H,21,25)(H,23,24)