2-methylpropyl (Z)-3-(1,3-benzodioxol-5-yl)-2-[(4-methylphenyl)carbonylamino]prop-2-enoate

Systemtic Name: 2-methylpropyl (Z)-3-(1,3-benzodioxol-5-yl)-2-[(4-methylphenyl)carbonylamino]prop-2-enoate Openeye Name: isobutyl (Z)-3-(1,3-benzodioxol-5-yl)-2-[(4-methylbenzoyl)amino]prop-2-enoate CAS Name: (Z)-3-(1,3-benzodioxol-5-yl)-2-[[(4-methylphenyl)-oxomethyl]amino]-2-propenoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl (Z)-3-(1,3-benzodioxol-5-yl)-2-[(4-methylbenzoyl)amino]prop-2-enoate Traditional Name: (Z)-3-(1,3-benzodioxol-5-yl)-2-(p-toluoylamino)acrylic acid isobutyl ester Formula: C22H23NO5 MolecularWeight: 381.42172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=CC2=CC3=C(C=C2)OCO3)C(=O)OCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N/C(=C\C2=CC3=C(C=C2)OCO3)/C(=O)OCC(C)C

InChI

InChI=1S/C22H23NO5/c1-14(2)12-26-22(25)18(23-21(24)17-7-4-15(3)5-8-17)10-16-6-9-19-20(11-16)28-13-27-19/h4-11,14H,12-13H2,1-3H3,(H,23,24)/b18-10-