prop-2-ynyl (Z)-2-[(3-bromophenyl)carbonylamino]-3-(4-propan-2-yloxyphenyl)prop-2-enoate

Systemtic Name: prop-2-ynyl (Z)-2-[(3-bromophenyl)carbonylamino]-3-(4-propan-2-yloxyphenyl)prop-2-enoate Openeye Name: prop-2-ynyl (Z)-2-[(3-bromobenzoyl)amino]-3-(4-isopropoxyphenyl)prop-2-enoate CAS Name: (Z)-2-[[(3-bromophenyl)-oxomethyl]amino]-3-(4-propan-2-yloxyphenyl)-2-propenoic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl (Z)-2-[(3-bromobenzoyl)amino]-3-(4-propan-2-yloxyphenyl)prop-2-enoate Traditional Name: (Z)-2-[(3-bromobenzoyl)amino]-3-(4-isopropoxyphenyl)acrylic acid propargyl ester Formula: C22H20BrNO4 MolecularWeight: 442.3025

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C=C(C(=O)OCC#C)NC(=O)C2=CC(=CC=C2)Br

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)/C=C(/C(=O)OCC#C)\NC(=O)C2=CC(=CC=C2)Br

InChI

InChI=1S/C22H20BrNO4/c1-4-12-27-22(26)20(24-21(25)17-6-5-7-18(23)14-17)13-16-8-10-19(11-9-16)28-15(2)3/h1,5-11,13-15H,12H2,2-3H3,(H,24,25)/b20-13-