6-[[(Z)-3-naphthalen-2-ylbut-2-enoyl]amino]-1,3-benzodioxole-5-carboxylic acid

Systemtic Name: 6-[[(Z)-3-naphthalen-2-ylbut-2-enoyl]amino]-1,3-benzodioxole-5-carboxylic acid Openeye Name: 6-[[(Z)-3-(2-naphthyl)but-2-enoyl]amino]-1,3-benzodioxole-5-carboxylic acid CAS Name: 6-[[(Z)-3-(2-naphthalenyl)-1-oxobut-2-enyl]amino]-1,3-benzodioxole-5-carboxylic acid IUPAC Name: 6-[[(Z)-3-naphthalen-2-ylbut-2-enoyl]amino]-1,3-benzodioxole-5-carboxylic acid Traditional Name: 6-[[(Z)-3-(2-naphthyl)but-2-enoyl]amino]-piperonylic acid Formula: C22H17NO5 MolecularWeight: 375.37408

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=CC2=C(C=C1C(=O)O)OCO2)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C/C(=C/C(=O)NC1=CC2=C(C=C1C(=O)O)OCO2)/C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H17NO5/c1-13(15-7-6-14-4-2-3-5-16(14)9-15)8-21(24)23-18-11-20-19(27-12-28-20)10-17(18)22(25)26/h2-11H,12H2,1H3,(H,23,24)(H,25,26)/b13-8-