2-[3-(2-phenylethanoylamino)propanoyl]-1,2-diazinane-3-carboxylic acid

Systemtic Name: 2-[3-(2-phenylethanoylamino)propanoyl]-1,2-diazinane-3-carboxylic acid Openeye Name: 2-[3-[(2-phenylacetyl)amino]propanoyl]hexahydropyridazine-3-carboxylic acid CAS Name: 2-[1-oxo-3-[(1-oxo-2-phenylethyl)amino]propyl]-3-diazinanecarboxylic acid IUPAC Name: 2-[3-[(2-phenylacetyl)amino]propanoyl]diazinane-3-carboxylic acid Traditional Name: 2-[3-[(2-phenylacetyl)amino]propanoyl]hexahydropyridazine-3-carboxylic acid Formula: C16H21N3O4 MolecularWeight: 319.35564

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(NC1)C(=O)CCNC(=O)CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1CC(N(NC1)C(=O)CCNC(=O)CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C16H21N3O4/c20-14(11-12-5-2-1-3-6-12)17-10-8-15(21)19-13(16(22)23)7-4-9-18-19/h1-3,5-6,13,18H,4,7-11H2,(H,17,20)(H,22,23)