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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NCC2=CC(=C(C=C2)OC)C(=O)O

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)NCC2=CC(=C(C=C2)OC)C(=O)O

InChI

InChI=1S/C19H21NO4/c1-3-15(14-7-5-4-6-8-14)18(21)20-12-13-9-10-17(24-2)16(11-13)19(22)23/h4-11,15H,3,12H2,1-2H3,(H,20,21)(H,22,23)