2-[[3-oxidanylidene-3-(phenethylamino)propanoyl]amino]benzoic acid

Systemtic Name: 2-[[3-oxidanylidene-3-(phenethylamino)propanoyl]amino]benzoic acid Openeye Name: 2-[[3-oxo-3-(phenethylamino)propanoyl]amino]benzoic acid CAS Name: 2-[[1,3-dioxo-3-(phenethylamino)propyl]amino]benzoic acid IUPAC Name: 2-[[3-oxo-3-(phenethylamino)propanoyl]amino]benzoic acid Traditional Name: 2-[[3-keto-3-(phenethylamino)propanoyl]amino]benzoic acid Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CC(=O)NC2=CC=CC=C2C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CC(=O)NC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C18H18N2O4/c21-16(19-11-10-13-6-2-1-3-7-13)12-17(22)20-15-9-5-4-8-14(15)18(23)24/h1-9H,10-12H2,(H,19,21)(H,20,22)(H,23,24)