2-[3-[1,3-benzodioxol-5-ylcarbonyl-(phenylmethyl)amino]phenyl]ethanoic acid

Systemtic Name: 2-[3-[1,3-benzodioxol-5-ylcarbonyl-(phenylmethyl)amino]phenyl]ethanoic acid Openeye Name: 2-[3-[1,3-benzodioxole-5-carbonyl(benzyl)amino]phenyl]acetic acid CAS Name: 2-[3-[[1,3-benzodioxol-5-yl(oxo)methyl]-(phenylmethyl)amino]phenyl]acetic acid IUPAC Name: 2-[3-[1,3-benzodioxole-5-carbonyl(benzyl)amino]phenyl]acetic acid Traditional Name: 2-[3-[benzyl(piperonyloyl)amino]phenyl]acetic acid Formula: C23H19NO5 MolecularWeight: 389.40066

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)N(CC3=CC=CC=C3)C4=CC=CC(=C4)CC(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)N(CC3=CC=CC=C3)C4=CC=CC(=C4)CC(=O)O

InChI

InChI=1S/C23H19NO5/c25-22(26)12-17-7-4-8-19(11-17)24(14-16-5-2-1-3-6-16)23(27)18-9-10-20-21(13-18)29-15-28-20/h1-11,13H,12,14-15H2,(H,25,26)