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2-[3-(diethylamino)propyl]-N,N-diethyl-1-oxidanylidene-isoquinoline-4-carboxamide; ethanedioic acid

2-[3-(diethylamino)propyl]-N,N-diethyl-1-oxidanylidene-isoquinoline-4-carboxamide; ethanedioic acid

Systemtic Name:2-[3-(diethylamino)propyl]-N,N-diethyl-1-oxidanylidene-isoquinoline-4-carboxamide; ethanedioic acid
Openeye Name:2-[3-(diethylamino)propyl]-N,N-diethyl-1-oxo-isoquinoline-4-carboxamide; oxalic acid
CAS Name:2-[3-(diethylamino)propyl]-N,N-diethyl-1-oxo-4-isoquinolinecarboxamide; oxalic acid
IUPAC Name:2-[3-(diethylamino)propyl]-N,N-diethyl-1-oxoisoquinoline-4-carboxamide; oxalic acid
Traditional Name:2-[3-(diethylamino)propyl]-N,N-diethyl-1-keto-isoquinoline-4-carboxamide; oxalic acid
Formula: C23H33N3O6
MolecularWeight: 447.52462
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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCN1C=C(C2=CC=CC=C2C1=O)C(=O)N(CC)CC.C(=O)(C(=O)O)O


Isomeric SMILES

CCN(CC)CCCN1C=C(C2=CC=CC=C2C1=O)C(=O)N(CC)CC.C(=O)(C(=O)O)O


InChI

InChI=1S/C21H31N3O2.C2H2O4/c1-5-22(6-2)14-11-15-24-16-19(21(26)23(7-3)8-4)17-12-9-10-13-18(17)20(24)25;3-1(4)2(5)6/h9-10,12-13,16H,5-8,11,14-15H2,1-4H3;(H,3,4)(H,5,6)


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