2-[3-[(E)-2-cyano-3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-prop-1-enyl]indol-1-yl]ethanamide

Systemtic Name: 2-[3-[(E)-2-cyano-3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-prop-1-enyl]indol-1-yl]ethanamide Openeye Name: 2-[3-[(E)-2-cyano-3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxo-prop-1-enyl]indol-1-yl]acetamide CAS Name: 2-[3-[(E)-2-cyano-3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxoprop-1-enyl]-1-indolyl]acetamide IUPAC Name: 2-[3-[(E)-2-cyano-3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxoprop-1-enyl]indol-1-yl]acetamide Traditional Name: 2-[3-[(E)-2-cyano-3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-keto-prop-1-enyl]indol-1-yl]acetamide Formula: C23H20N4O2 MolecularWeight: 384.4305

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C(=CC3=CN(C4=CC=CC=C43)CC(=O)N)C#N

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)/C(=C/C3=CN(C4=CC=CC=C43)CC(=O)N)/C#N

InChI

InChI=1S/C23H20N4O2/c24-12-18(23(29)26-10-9-16-5-1-2-6-17(16)13-26)11-19-14-27(15-22(25)28)21-8-4-3-7-20(19)21/h1-8,11,14H,9-10,13,15H2,(H2,25,28)/b18-11+