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

Systemtic Name: prop-2-ynyl (Z)-2-[(3-nitrophenyl)carbonylamino]-3-(4-propan-2-yloxyphenyl)prop-2-enoate Openeye Name: prop-2-ynyl (Z)-3-(4-isopropoxyphenyl)-2-[(3-nitrobenzoyl)amino]prop-2-enoate CAS Name: (Z)-2-[[(3-nitrophenyl)-oxomethyl]amino]-3-(4-propan-2-yloxyphenyl)-2-propenoic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl (Z)-2-[(3-nitrobenzoyl)amino]-3-(4-propan-2-yloxyphenyl)prop-2-enoate Traditional Name: (Z)-3-(4-isopropoxyphenyl)-2-[(3-nitrobenzoyl)amino]acrylic acid propargyl ester Formula: C22H20N2O6 MolecularWeight: 408.404

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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)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)/C=C(/C(=O)OCC#C)\NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C22H20N2O6/c1-4-12-29-22(26)20(13-16-8-10-19(11-9-16)30-15(2)3)23-21(25)17-6-5-7-18(14-17)24(27)28/h1,5-11,13-15H,12H2,2-3H3,(H,23,25)/b20-13-