3-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(4-chloranyl-2-methoxy-5-methyl-phenyl)propanamide

Systemtic Name: 3-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(4-chloranyl-2-methoxy-5-methyl-phenyl)propanamide Openeye Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-3-(1,4-dioxo-3H-phthalazin-2-yl)propanamide CAS Name: N-(4-chloro-2-methoxy-5-methylphenyl)-3-(1,4-dioxo-3H-phthalazin-2-yl)propanamide IUPAC Name: N-(4-chloro-2-methoxy-5-methylphenyl)-3-(1,4-dioxo-3H-phthalazin-2-yl)propanamide Traditional Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-3-(1,4-diketo-3H-phthalazin-2-yl)propionamide Formula: C19H18ClN3O4 MolecularWeight: 387.81692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)CCN2C(=O)C3=CC=CC=C3C(=O)N2

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)CCN2C(=O)C3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C19H18ClN3O4/c1-11-9-15(16(27-2)10-14(11)20)21-17(24)7-8-23-19(26)13-6-4-3-5-12(13)18(25)22-23/h3-6,9-10H,7-8H2,1-2H3,(H,21,24)(H,22,25)