7-chloranyl-2-[3-(dimethylamino)propyl]-N,N-dimethyl-1-oxidanylidene-isoquinoline-4-carboxamide; ethanedioic acid

Systemtic Name: 7-chloranyl-2-[3-(dimethylamino)propyl]-N,N-dimethyl-1-oxidanylidene-isoquinoline-4-carboxamide; ethanedioic acid Openeye Name: 7-chloro-2-[3-(dimethylamino)propyl]-N,N-dimethyl-1-oxo-isoquinoline-4-carboxamide; oxalic acid CAS Name: 7-chloro-2-[3-(dimethylamino)propyl]-N,N-dimethyl-1-oxo-4-isoquinolinecarboxamide; oxalic acid IUPAC Name: 7-chloro-2-[3-(dimethylamino)propyl]-N,N-dimethyl-1-oxoisoquinoline-4-carboxamide; oxalic acid Traditional Name: 7-chloro-2-[3-(dimethylamino)propyl]-1-keto-N,N-dimethyl-isoquinoline-4-carboxamide; oxalic acid Formula: C19H24ClN3O6 MolecularWeight: 425.86336

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN1C=C(C2=C(C1=O)C=C(C=C2)Cl)C(=O)N(C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CN(C)CCCN1C=C(C2=C(C1=O)C=C(C=C2)Cl)C(=O)N(C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H22ClN3O2.C2H2O4/c1-19(2)8-5-9-21-11-15(16(22)20(3)4)13-7-6-12(18)10-14(13)17(21)23;3-1(4)2(5)6/h6-7,10-11H,5,8-9H2,1-4H3;(H,3,4)(H,5,6)