6-chloranyl-3-[3-(dimethylamino)propyl]-4-phenyl-1,4-dihydroquinazolin-2-one; 2-oxidanylpropane-1,2,3-tricarboxylate

Systemtic Name: 6-chloranyl-3-[3-(dimethylamino)propyl]-4-phenyl-1,4-dihydroquinazolin-2-one; 2-oxidanylpropane-1,2,3-tricarboxylate Openeye Name: 6-chloro-3-[3-(dimethylamino)propyl]-4-phenyl-1,4-dihydroquinazolin-2-one citrate CAS Name: 6-chloro-3-[3-(dimethylamino)propyl]-4-phenyl-1,4-dihydroquinazolin-2-one; 2-hydroxypropane-1,2,3-tricarboxylate IUPAC Name: 6-chloro-3-[3-(dimethylamino)propyl]-4-phenyl-1,4-dihydroquinazolin-2-one; 2-hydroxypropane-1,2,3-tricarboxylate Traditional Name: 6-chloro-3-[3-(dimethylamino)propyl]-4-phenyl-1,4-dihydroquinazolin-2-one citrate Formula: C25H27ClN3O8-3 MolecularWeight: 532.95018

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN1C(C2=C(C=CC(=C2)Cl)NC1=O)C3=CC=CC=C3.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

Isomeric SMILES

CN(C)CCCN1C(C2=C(C=CC(=C2)Cl)NC1=O)C3=CC=CC=C3.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

InChI

InChI=1S/C19H22ClN3O.C6H8O7/c1-22(2)11-6-12-23-18(14-7-4-3-5-8-14)16-13-15(20)9-10-17(16)21-19(23)24;7-3(8)1-6(13,5(11)12)2-4(9)10/h3-5,7-10,13,18H,6,11-12H2,1-2H3,(H,21,24);13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/p-3