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2-[3-[6-(1-hydroxyethyl)naphthalen-2-yl]propanoylamino]benzoic acid

2-[3-[6-(1-hydroxyethyl)naphthalen-2-yl]propanoylamino]benzoic acid

Systemtic Name:2-[3-[6-(1-hydroxyethyl)naphthalen-2-yl]propanoylamino]benzoic acid
Openeye Name:2-[3-[6-(1-hydroxyethyl)-2-naphthyl]propanoylamino]benzoic acid
CAS Name:2-[[3-[6-(1-hydroxyethyl)-2-naphthalenyl]-1-oxopropyl]amino]benzoic acid
IUPAC Name:2-[3-[6-(1-hydroxyethyl)naphthalen-2-yl]propanoylamino]benzoic acid
Traditional Name:2-[3-[6-(1-hydroxyethyl)-2-naphthyl]propanoylamino]benzoic acid
Formula: C22H21NO4
MolecularWeight: 363.40644
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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)C=C(C=C2)CCC(=O)NC3=CC=CC=C3C(=O)O)O


Isomeric SMILES

CC(C1=CC2=C(C=C1)C=C(C=C2)CCC(=O)NC3=CC=CC=C3C(=O)O)O


InChI

InChI=1S/C22H21NO4/c1-14(24)16-9-10-17-12-15(6-8-18(17)13-16)7-11-21(25)23-20-5-3-2-4-19(20)22(26)27/h2-6,8-10,12-14,24H,7,11H2,1H3,(H,23,25)(H,26,27)


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