(Z)-3-[(4-bromanyl-3-methyl-phenyl)amino]-2-cyclopropylcarbonyl-3-oxidanyl-prop-2-enenitrile

Systemtic Name: (Z)-3-[(4-bromanyl-3-methyl-phenyl)amino]-2-cyclopropylcarbonyl-3-oxidanyl-prop-2-enenitrile Openeye Name: (Z)-3-(4-bromo-3-methyl-anilino)-2-(cyclopropanecarbonyl)-3-hydroxy-prop-2-enenitrile CAS Name: (Z)-3-(4-bromo-3-methylanilino)-2-[cyclopropyl(oxo)methyl]-3-hydroxy-2-propenenitrile IUPAC Name: (Z)-3-(4-bromo-3-methylanilino)-2-(cyclopropanecarbonyl)-3-hydroxyprop-2-enenitrile Traditional Name: (Z)-3-(4-bromo-3-methyl-anilino)-2-(cyclopropanecarbonyl)-3-hydroxy-acrylonitrile Formula: C14H13BrN2O2 MolecularWeight: 321.16922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=C(C#N)C(=O)C2CC2)O)Br

Isomeric SMILES

CC1=C(C=CC(=C1)N/C(=C(\C#N)/C(=O)C2CC2)/O)Br

InChI

InChI=1S/C14H13BrN2O2/c1-8-6-10(4-5-12(8)15)17-14(19)11(7-16)13(18)9-2-3-9/h4-6,9,17,19H,2-3H2,1H3/b14-11-