1-oxidanylidene-N-prop-2-ynyl-2H-isoquinoline-3-carboxamide

Systemtic Name: 1-oxidanylidene-N-prop-2-ynyl-2H-isoquinoline-3-carboxamide Openeye Name: 1-oxo-N-prop-2-ynyl-2H-isoquinoline-3-carboxamide CAS Name: 1-oxo-N-prop-2-ynyl-2H-isoquinoline-3-carboxamide IUPAC Name: 1-oxo-N-prop-2-ynyl-2H-isoquinoline-3-carboxamide Traditional Name: 1-keto-N-propargyl-2H-isoquinoline-3-carboxamide Formula: C13H10N2O2 MolecularWeight: 226.2307

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)C1=CC2=CC=CC=C2C(=O)N1

Isomeric SMILES

C#CCNC(=O)C1=CC2=CC=CC=C2C(=O)N1

InChI

InChI=1S/C13H10N2O2/c1-2-7-14-13(17)11-8-9-5-3-4-6-10(9)12(16)15-11/h1,3-6,8H,7H2,(H,14,17)(H,15,16)