(2S,3R)-4-oxidanylidene-1-(phenylcarbamoyl)-3-(piperidin-4-ylmethyl)azetidine-2-carboxylic acid

Systemtic Name: (2S,3R)-4-oxidanylidene-1-(phenylcarbamoyl)-3-(piperidin-4-ylmethyl)azetidine-2-carboxylic acid Openeye Name: (2S,3R)-4-oxo-1-(phenylcarbamoyl)-3-(4-piperidylmethyl)azetidine-2-carboxylic acid CAS Name: (2S,3R)-1-[anilino(oxo)methyl]-4-oxo-3-(4-piperidinylmethyl)-2-azetidinecarboxylic acid IUPAC Name: (2S,3R)-4-oxo-1-(phenylcarbamoyl)-3-(piperidin-4-ylmethyl)azetidine-2-carboxylic acid Traditional Name: (2S,3R)-4-keto-1-(phenylcarbamoyl)-3-(4-piperidylmethyl)azetidine-2-carboxylic acid Formula: C17H21N3O4 MolecularWeight: 331.36634

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1CC2C(N(C2=O)C(=O)NC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CNCCC1C[C@@H]2[C@H](N(C2=O)C(=O)NC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C17H21N3O4/c21-15-13(10-11-6-8-18-9-7-11)14(16(22)23)20(15)17(24)19-12-4-2-1-3-5-12/h1-5,11,13-14,18H,6-10H2,(H,19,24)(H,22,23)/t13-,14+/m1/s1