2-[(Z)-but-2-enoyl]-1-methyl-isoquinoline-1-carbonitrile

Systemtic Name: 2-[(Z)-but-2-enoyl]-1-methyl-isoquinoline-1-carbonitrile Openeye Name: 2-[(Z)-but-2-enoyl]-1-methyl-isoquinoline-1-carbonitrile CAS Name: 1-methyl-2-[(Z)-1-oxobut-2-enyl]-1-isoquinolinecarbonitrile IUPAC Name: 2-[(Z)-but-2-enoyl]-1-methylisoquinoline-1-carbonitrile Traditional Name: 2-[(Z)-but-2-enoyl]-1-methyl-isoquinoline-1-carbonitrile Formula: C15H14N2O MolecularWeight: 238.28446

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)N1C=CC2=CC=CC=C2C1(C)C#N

Isomeric SMILES

C/C=C\C(=O)N1C=CC2=CC=CC=C2C1(C)C#N

InChI

InChI=1S/C15H14N2O/c1-3-6-14(18)17-10-9-12-7-4-5-8-13(12)15(17,2)11-16/h3-10H,1-2H3/b6-3-