methyl 4-[[6-[(2,4-dichlorophenyl)carbamoylamino]-4-oxidanylidene-3H-phthalazin-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[6-[(2,4-dichlorophenyl)carbamoylamino]-4-oxidanylidene-3H-phthalazin-1-yl]methyl]benzoate Openeye Name: methyl 4-[[6-[(2,4-dichlorophenyl)carbamoylamino]-4-oxo-3H-phthalazin-1-yl]methyl]benzoate CAS Name: 4-[[6-[[(2,4-dichloroanilino)-oxomethyl]amino]-4-oxo-3H-phthalazin-1-yl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[6-[(2,4-dichlorophenyl)carbamoylamino]-4-oxo-3H-phthalazin-1-yl]methyl]benzoate Traditional Name: 4-[[6-[(2,4-dichlorophenyl)carbamoylamino]-4-keto-3H-phthalazin-1-yl]methyl]benzoic acid methyl ester Formula: C24H18Cl2N4O4 MolecularWeight: 497.33012

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CC2=NNC(=O)C3=C2C=CC(=C3)NC(=O)NC4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CC2=NNC(=O)C3=C2C=CC(=C3)NC(=O)NC4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C24H18Cl2N4O4/c1-34-23(32)14-4-2-13(3-5-14)10-21-17-8-7-16(12-18(17)22(31)30-29-21)27-24(33)28-20-9-6-15(25)11-19(20)26/h2-9,11-12H,10H2,1H3,(H,30,31)(H2,27,28,33)