4-[3-[(2-azanyl-3-phenyl-propanoyl)amino]-4-oxidanylidene-azetidin-2-yl]oxybenzoic acid

Systemtic Name: 4-[3-[(2-azanyl-3-phenyl-propanoyl)amino]-4-oxidanylidene-azetidin-2-yl]oxybenzoic acid Openeye Name: 4-[3-[(2-amino-3-phenyl-propanoyl)amino]-4-oxo-azetidin-2-yl]oxybenzoic acid CAS Name: 4-[[3-[(2-amino-1-oxo-3-phenylpropyl)amino]-4-oxo-2-azetidinyl]oxy]benzoic acid IUPAC Name: 4-[3-[(2-amino-3-phenylpropanoyl)amino]-4-oxoazetidin-2-yl]oxybenzoic acid Traditional Name: 4-[4-keto-3-(phenylalanylamino)azetidin-2-yl]oxybenzoic acid Formula: C19H19N3O5 MolecularWeight: 369.37126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC2C(NC2=O)OC3=CC=C(C=C3)C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NC2C(NC2=O)OC3=CC=C(C=C3)C(=O)O)N

InChI

InChI=1S/C19H19N3O5/c20-14(10-11-4-2-1-3-5-11)16(23)21-15-17(24)22-18(15)27-13-8-6-12(7-9-13)19(25)26/h1-9,14-15,18H,10,20H2,(H,21,23)(H,22,24)(H,25,26)