ethyl 6-[[(Z)-2-[(3-bromophenyl)carbonylamino]-3-phenyl-prop-2-enoyl]amino]hexanoate

Systemtic Name: ethyl 6-[[(Z)-2-[(3-bromophenyl)carbonylamino]-3-phenyl-prop-2-enoyl]amino]hexanoate Openeye Name: ethyl 6-[[(Z)-2-[(3-bromobenzoyl)amino]-3-phenyl-prop-2-enoyl]amino]hexanoate CAS Name: 6-[[(Z)-2-[[(3-bromophenyl)-oxomethyl]amino]-1-oxo-3-phenylprop-2-enyl]amino]hexanoic acid ethyl ester IUPAC Name: ethyl 6-[[(Z)-2-[(3-bromobenzoyl)amino]-3-phenylprop-2-enoyl]amino]hexanoate Traditional Name: 6-[[(Z)-2-[(3-bromobenzoyl)amino]-3-phenyl-acryloyl]amino]hexanoic acid ethyl ester Formula: C24H27BrN2O4 MolecularWeight: 487.38618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCNC(=O)C(=CC1=CC=CC=C1)NC(=O)C2=CC(=CC=C2)Br

Isomeric SMILES

CCOC(=O)CCCCCNC(=O)/C(=C/C1=CC=CC=C1)/NC(=O)C2=CC(=CC=C2)Br

InChI

InChI=1S/C24H27BrN2O4/c1-2-31-22(28)14-7-4-8-15-26-24(30)21(16-18-10-5-3-6-11-18)27-23(29)19-12-9-13-20(25)17-19/h3,5-6,9-13,16-17H,2,4,7-8,14-15H2,1H3,(H,26,30)(H,27,29)/b21-16-