(2S)-2-[[(1S)-cyclohex-3-en-1-yl]carbonylamino]-3-(4-hydroxyphenyl)propanoic acid

Systemtic Name: (2S)-2-[[(1S)-cyclohex-3-en-1-yl]carbonylamino]-3-(4-hydroxyphenyl)propanoic acid Openeye Name: (2S)-2-[[(1S)-cyclohex-3-ene-1-carbonyl]amino]-3-(4-hydroxyphenyl)propanoic acid CAS Name: (2S)-2-[[[(1S)-1-cyclohex-3-enyl]-oxomethyl]amino]-3-(4-hydroxyphenyl)propanoic acid IUPAC Name: (2S)-2-[[(1S)-cyclohex-3-ene-1-carbonyl]amino]-3-(4-hydroxyphenyl)propanoic acid Traditional Name: (2S)-2-[[(1S)-cyclohex-3-ene-1-carbonyl]amino]-3-(4-hydroxyphenyl)propionic acid Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1)C(=O)NC(CC2=CC=C(C=C2)O)C(=O)O

Isomeric SMILES

C1C[C@@H](CC=C1)C(=O)N[C@@H](CC2=CC=C(C=C2)O)C(=O)O

InChI

InChI=1S/C16H19NO4/c18-13-8-6-11(7-9-13)10-14(16(20)21)17-15(19)12-4-2-1-3-5-12/h1-2,6-9,12,14,18H,3-5,10H2,(H,17,19)(H,20,21)/t12-,14+/m1/s1