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2-methoxy-5-[(3-phenylbutanoylamino)methyl]benzoic acid

2-methoxy-5-[(3-phenylbutanoylamino)methyl]benzoic acid

Systemtic Name:2-methoxy-5-[(3-phenylbutanoylamino)methyl]benzoic acid
Openeye Name:2-methoxy-5-[(3-phenylbutanoylamino)methyl]benzoic acid
CAS Name:2-methoxy-5-[[(1-oxo-3-phenylbutyl)amino]methyl]benzoic acid
IUPAC Name:2-methoxy-5-[(3-phenylbutanoylamino)methyl]benzoic acid
Traditional Name:2-methoxy-5-[(3-phenylbutanoylamino)methyl]benzoic acid
Formula: C19H21NO4
MolecularWeight: 327.37434
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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NCC1=CC(=C(C=C1)OC)C(=O)O)C2=CC=CC=C2


Isomeric SMILES

CC(CC(=O)NCC1=CC(=C(C=C1)OC)C(=O)O)C2=CC=CC=C2


InChI

InChI=1S/C19H21NO4/c1-13(15-6-4-3-5-7-15)10-18(21)20-12-14-8-9-17(24-2)16(11-14)19(22)23/h3-9,11,13H,10,12H2,1-2H3,(H,20,21)(H,22,23)


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