3-(dimethylamino)propyl 4-oxidanylidene-3-phenyl-phthalazine-1-carboxylate hydrochloride

Systemtic Name: 3-(dimethylamino)propyl 4-oxidanylidene-3-phenyl-phthalazine-1-carboxylate hydrochloride Openeye Name: 3-(dimethylamino)propyl 4-oxo-3-phenyl-phthalazine-1-carboxylate hydrochloride CAS Name: 4-oxo-3-phenyl-1-phthalazinecarboxylic acid 3-(dimethylamino)propyl ester hydrochloride IUPAC Name: 3-(dimethylamino)propyl 4-oxo-3-phenylphthalazine-1-carboxylate hydrochloride Traditional Name: 4-keto-3-phenyl-phthalazine-1-carboxylic acid 3-(dimethylamino)propyl ester hydrochloride Formula: C20H22ClN3O3 MolecularWeight: 387.85998

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCOC(=O)C1=NN(C(=O)C2=CC=CC=C21)C3=CC=CC=C3.Cl

Isomeric SMILES

CN(C)CCCOC(=O)C1=NN(C(=O)C2=CC=CC=C21)C3=CC=CC=C3.Cl

InChI

InChI=1S/C20H21N3O3.ClH/c1-22(2)13-8-14-26-20(25)18-16-11-6-7-12-17(16)19(24)23(21-18)15-9-4-3-5-10-15;/h3-7,9-12H,8,13-14H2,1-2H3;1H