(E)-3-(1,3-benzodioxol-5-yl)-2-(naphthalen-1-ylcarbonylamino)prop-2-enoic acid

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-2-(naphthalen-1-ylcarbonylamino)prop-2-enoic acid Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-2-(naphthalene-1-carbonylamino)prop-2-enoic acid CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-2-[[1-naphthalenyl(oxo)methyl]amino]-2-propenoic acid IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-2-(naphthalene-1-carbonylamino)prop-2-enoic acid Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-2-(1-naphthoylamino)acrylic acid Formula: C21H15NO5 MolecularWeight: 361.3475

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=C(C(=O)O)NC(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C(\C(=O)O)/NC(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H15NO5/c23-20(16-7-3-5-14-4-1-2-6-15(14)16)22-17(21(24)25)10-13-8-9-18-19(11-13)27-12-26-18/h1-11H,12H2,(H,22,23)(H,24,25)/b17-10+