[4-bromanyl-2-[(E)-3-(4-methylphenyl)prop-2-enoyl]phenyl] morpholine-4-carboxylate

Systemtic Name: [4-bromanyl-2-[(E)-3-(4-methylphenyl)prop-2-enoyl]phenyl] morpholine-4-carboxylate Openeye Name: [4-bromo-2-[(E)-3-(p-tolyl)prop-2-enoyl]phenyl] morpholine-4-carboxylate CAS Name: 4-morpholinecarboxylic acid [4-bromo-2-[(E)-3-(4-methylphenyl)-1-oxoprop-2-enyl]phenyl] ester IUPAC Name: [4-bromo-2-[(E)-3-(4-methylphenyl)prop-2-enoyl]phenyl] morpholine-4-carboxylate Traditional Name: morpholine-4-carboxylic acid [4-bromo-2-[(E)-3-(p-tolyl)acryloyl]phenyl] ester Formula: C21H20BrNO4 MolecularWeight: 430.2918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC(=O)C2=C(C=CC(=C2)Br)OC(=O)N3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C(=O)C2=C(C=CC(=C2)Br)OC(=O)N3CCOCC3

InChI

InChI=1S/C21H20BrNO4/c1-15-2-4-16(5-3-15)6-8-19(24)18-14-17(22)7-9-20(18)27-21(25)23-10-12-26-13-11-23/h2-9,14H,10-13H2,1H3/b8-6+