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

Systemtic Name: (phenylmethyl) (Z)-3-(1,3-benzodioxol-5-yl)-2-[(3-nitrophenyl)carbonylamino]prop-2-enoate Openeye Name: benzyl (Z)-3-(1,3-benzodioxol-5-yl)-2-[(3-nitrobenzoyl)amino]prop-2-enoate CAS Name: (Z)-3-(1,3-benzodioxol-5-yl)-2-[[(3-nitrophenyl)-oxomethyl]amino]-2-propenoic acid (phenylmethyl) ester IUPAC Name: benzyl (Z)-3-(1,3-benzodioxol-5-yl)-2-[(3-nitrobenzoyl)amino]prop-2-enoate Traditional Name: (Z)-3-(1,3-benzodioxol-5-yl)-2-[(3-nitrobenzoyl)amino]acrylic acid benzyl ester Formula: C24H18N2O7 MolecularWeight: 446.40892

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=C(C(=O)OCC3=CC=CC=C3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C(/C(=O)OCC3=CC=CC=C3)\NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H18N2O7/c27-23(18-7-4-8-19(13-18)26(29)30)25-20(24(28)31-14-16-5-2-1-3-6-16)11-17-9-10-21-22(12-17)33-15-32-21/h1-13H,14-15H2,(H,25,27)/b20-11-