methyl 1-[[(E)-3-(3-bromophenyl)prop-2-enoyl]amino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[[(E)-3-(3-bromophenyl)prop-2-enoyl]amino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[[(E)-3-(3-bromophenyl)prop-2-enoyl]amino]cyclohexanecarboxylate CAS Name: 1-[[(E)-3-(3-bromophenyl)-1-oxoprop-2-enyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[(E)-3-(3-bromophenyl)prop-2-enoyl]amino]cyclohexane-1-carboxylate Traditional Name: 1-[[(E)-3-(3-bromophenyl)acryloyl]amino]cyclohexanecarboxylic acid methyl ester Formula: C17H20BrNO3 MolecularWeight: 366.2496

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCCCC1)NC(=O)C=CC2=CC(=CC=C2)Br

Isomeric SMILES

COC(=O)C1(CCCCC1)NC(=O)/C=C/C2=CC(=CC=C2)Br

InChI

InChI=1S/C17H20BrNO3/c1-22-16(21)17(10-3-2-4-11-17)19-15(20)9-8-13-6-5-7-14(18)12-13/h5-9,12H,2-4,10-11H2,1H3,(H,19,20)/b9-8+