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ethanedioic acid; 2-ethyl-3-(4-pyrrolidin-1-ylbut-2-ynyl)quinazolin-4-one

ethanedioic acid; 2-ethyl-3-(4-pyrrolidin-1-ylbut-2-ynyl)quinazolin-4-one

Systemtic Name:ethanedioic acid; 2-ethyl-3-(4-pyrrolidin-1-ylbut-2-ynyl)quinazolin-4-one
Openeye Name:2-ethyl-3-(4-pyrrolidin-1-ylbut-2-ynyl)quinazolin-4-one; oxalic acid
CAS Name:2-ethyl-3-[4-(1-pyrrolidinyl)but-2-ynyl]-4-quinazolinone; oxalic acid
IUPAC Name:2-ethyl-3-(4-pyrrolidin-1-ylbut-2-ynyl)quinazolin-4-one; oxalic acid
Traditional Name:2-ethyl-3-(4-pyrrolidinobut-2-ynyl)quinazolin-4-one; oxalic acid
Formula: C20H23N3O5
MolecularWeight: 385.41372
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=O)N1CC#CCN3CCCC3.C(=O)(C(=O)O)O


Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=O)N1CC#CCN3CCCC3.C(=O)(C(=O)O)O


InChI

InChI=1S/C18H21N3O.C2H2O4/c1-2-17-19-16-10-4-3-9-15(16)18(22)21(17)14-8-7-13-20-11-5-6-12-20;3-1(4)2(5)6/h3-4,9-10H,2,5-6,11-14H2,1H3;(H,3,4)(H,5,6)


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