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2-[3-[4-(1,3-benzodioxol-5-yl)phenyl]propanoylamino]benzoic acid

2-[3-[4-(1,3-benzodioxol-5-yl)phenyl]propanoylamino]benzoic acid

Systemtic Name:2-[3-[4-(1,3-benzodioxol-5-yl)phenyl]propanoylamino]benzoic acid
Openeye Name:2-[3-[4-(1,3-benzodioxol-5-yl)phenyl]propanoylamino]benzoic acid
CAS Name:2-[[3-[4-(1,3-benzodioxol-5-yl)phenyl]-1-oxopropyl]amino]benzoic acid
IUPAC Name:2-[3-[4-(1,3-benzodioxol-5-yl)phenyl]propanoylamino]benzoic acid
Traditional Name:2-[3-[4-(1,3-benzodioxol-5-yl)phenyl]propanoylamino]benzoic acid
Formula: C23H19NO5
MolecularWeight: 389.40066
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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CC=C(C=C3)CCC(=O)NC4=CC=CC=C4C(=O)O


Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CC=C(C=C3)CCC(=O)NC4=CC=CC=C4C(=O)O


InChI

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


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