(Z)-2-cyclopropylcarbonyl-3-oxidanyl-3-[[4-(1-phenylethyl)phenyl]amino]prop-2-enenitrile

Systemtic Name: (Z)-2-cyclopropylcarbonyl-3-oxidanyl-3-[[4-(1-phenylethyl)phenyl]amino]prop-2-enenitrile Openeye Name: (Z)-2-(cyclopropanecarbonyl)-3-hydroxy-3-[4-(1-phenylethyl)anilino]prop-2-enenitrile CAS Name: (Z)-2-[cyclopropyl(oxo)methyl]-3-hydroxy-3-[4-(1-phenylethyl)anilino]-2-propenenitrile IUPAC Name: (Z)-2-(cyclopropanecarbonyl)-3-hydroxy-3-[4-(1-phenylethyl)anilino]prop-2-enenitrile Traditional Name: (Z)-2-(cyclopropanecarbonyl)-3-hydroxy-3-[4-(1-phenylethyl)anilino]acrylonitrile Formula: C21H20N2O2 MolecularWeight: 332.3957

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)C2=CC=C(C=C2)NC(=C(C#N)C(=O)C3CC3)O

Isomeric SMILES

CC(C1=CC=CC=C1)C2=CC=C(C=C2)N/C(=C(\C#N)/C(=O)C3CC3)/O

InChI

InChI=1S/C21H20N2O2/c1-14(15-5-3-2-4-6-15)16-9-11-18(12-10-16)23-21(25)19(13-22)20(24)17-7-8-17/h2-6,9-12,14,17,23,25H,7-8H2,1H3/b21-19-