2-(2-methoxyethyl)-1-oxidanylidene-3-phenyl-N-prop-2-ynyl-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: 2-(2-methoxyethyl)-1-oxidanylidene-3-phenyl-N-prop-2-ynyl-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 2-(2-methoxyethyl)-1-oxo-3-phenyl-N-prop-2-ynyl-3,4-dihydroisoquinoline-4-carboxamide CAS Name: 2-(2-methoxyethyl)-1-oxo-3-phenyl-N-prop-2-ynyl-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: 2-(2-methoxyethyl)-1-oxo-3-phenyl-N-prop-2-ynyl-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 1-keto-2-(2-methoxyethyl)-3-phenyl-N-propargyl-3,4-dihydroisoquinoline-4-carboxamide Formula: C22H22N2O3 MolecularWeight: 362.42168

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(C(C2=CC=CC=C2C1=O)C(=O)NCC#C)C3=CC=CC=C3

Isomeric SMILES

COCCN1C(C(C2=CC=CC=C2C1=O)C(=O)NCC#C)C3=CC=CC=C3

InChI

InChI=1S/C22H22N2O3/c1-3-13-23-21(25)19-17-11-7-8-12-18(17)22(26)24(14-15-27-2)20(19)16-9-5-4-6-10-16/h1,4-12,19-20H,13-15H2,2H3,(H,23,25)