(2S)-2-[[(1S)-cyclohex-3-en-1-yl]carbonylamino]-3-(1H-imidazol-5-yl)propanoic acid

Systemtic Name: (2S)-2-[[(1S)-cyclohex-3-en-1-yl]carbonylamino]-3-(1H-imidazol-5-yl)propanoic acid Openeye Name: (2S)-2-[[(1S)-cyclohex-3-ene-1-carbonyl]amino]-3-(1H-imidazol-5-yl)propanoic acid CAS Name: (2S)-2-[[[(1S)-1-cyclohex-3-enyl]-oxomethyl]amino]-3-(1H-imidazol-5-yl)propanoic acid IUPAC Name: (2S)-2-[[(1S)-cyclohex-3-ene-1-carbonyl]amino]-3-(1H-imidazol-5-yl)propanoic acid Traditional Name: (2S)-2-[[(1S)-cyclohex-3-ene-1-carbonyl]amino]-3-(1H-imidazol-5-yl)propionic acid Formula: C13H17N3O3 MolecularWeight: 263.29238

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1)C(=O)NC(CC2=CN=CN2)C(=O)O

Isomeric SMILES

C1C[C@@H](CC=C1)C(=O)N[C@@H](CC2=CN=CN2)C(=O)O

InChI

InChI=1S/C13H17N3O3/c17-12(9-4-2-1-3-5-9)16-11(13(18)19)6-10-7-14-8-15-10/h1-2,7-9,11H,3-6H2,(H,14,15)(H,16,17)(H,18,19)/t9-,11+/m1/s1