methyl 2-[2-bromanyl-4-[(Z)-2-cyano-3-[(2-methylcyclohexyl)amino]-3-oxidanylidene-prop-1-enyl]phenoxy]ethanoate

Systemtic Name: methyl 2-[2-bromanyl-4-[(Z)-2-cyano-3-[(2-methylcyclohexyl)amino]-3-oxidanylidene-prop-1-enyl]phenoxy]ethanoate Openeye Name: methyl 2-[2-bromo-4-[(Z)-2-cyano-3-[(2-methylcyclohexyl)amino]-3-oxo-prop-1-enyl]phenoxy]acetate CAS Name: 2-[2-bromo-4-[(Z)-2-cyano-3-[(2-methylcyclohexyl)amino]-3-oxoprop-1-enyl]phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[2-bromo-4-[(Z)-2-cyano-3-[(2-methylcyclohexyl)amino]-3-oxoprop-1-enyl]phenoxy]acetate Traditional Name: 2-[2-bromo-4-[(Z)-2-cyano-3-keto-3-[(2-methylcyclohexyl)amino]prop-1-enyl]phenoxy]acetic acid methyl ester Formula: C20H23BrN2O4 MolecularWeight: 435.31162

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C(=CC2=CC(=C(C=C2)OCC(=O)OC)Br)C#N

Isomeric SMILES

CC1CCCCC1NC(=O)/C(=C\C2=CC(=C(C=C2)OCC(=O)OC)Br)/C#N

InChI

InChI=1S/C20H23BrN2O4/c1-13-5-3-4-6-17(13)23-20(25)15(11-22)9-14-7-8-18(16(21)10-14)27-12-19(24)26-2/h7-10,13,17H,3-6,12H2,1-2H3,(H,23,25)/b15-9-