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

Systemtic Name: (phenylmethyl) (Z)-3-(1,3-benzodioxol-5-yl)-2-[(4-methylphenyl)carbonylamino]prop-2-enoate Openeye Name: benzyl (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 (phenylmethyl) ester IUPAC Name: benzyl (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 benzyl ester Formula: C25H21NO5 MolecularWeight: 415.43794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=CC2=CC3=C(C=C2)OCO3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N/C(=C\C2=CC3=C(C=C2)OCO3)/C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C25H21NO5/c1-17-7-10-20(11-8-17)24(27)26-21(25(28)29-15-18-5-3-2-4-6-18)13-19-9-12-22-23(14-19)31-16-30-22/h2-14H,15-16H2,1H3,(H,26,27)/b21-13-