3-[2-[(3-chloranyl-4-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-[2-[(3-chloranyl-4-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-[2-(3-chloro-4-methoxy-anilino)-2-oxo-ethyl]-N-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: 3-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]-N-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]-N-methyl-4-oxophthalazine-1-carboxamide Traditional Name: 3-[2-(3-chloro-4-methoxy-anilino)-2-keto-ethyl]-4-keto-N-methyl-phthalazine-1-carboxamide Formula: C19H17ClN4O4 MolecularWeight: 400.81568

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC(=O)NC3=CC(=C(C=C3)OC)Cl

Isomeric SMILES

CNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC(=O)NC3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C19H17ClN4O4/c1-21-18(26)17-12-5-3-4-6-13(12)19(27)24(23-17)10-16(25)22-11-7-8-15(28-2)14(20)9-11/h3-9H,10H2,1-2H3,(H,21,26)(H,22,25)