(2S)-3-methyl-2-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-ylcarbonylamino)butanoate

Systemtic Name: (2S)-3-methyl-2-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-ylcarbonylamino)butanoate Openeye Name: (2S)-3-methyl-2-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonylamino)butanoate CAS Name: (2S)-3-methyl-2-[[oxo(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)methyl]amino]butanoate IUPAC Name: (2S)-3-methyl-2-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonylamino)butanoate Traditional Name: (2S)-3-methyl-2-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonylamino)butyrate Formula: C15H20NO3S- MolecularWeight: 294.3892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])NC(=O)C1=CC2=C(S1)CCCCC2

Isomeric SMILES

CC(C)[C@@H](C(=O)[O-])NC(=O)C1=CC2=C(S1)CCCCC2

InChI

InChI=1S/C15H21NO3S/c1-9(2)13(15(18)19)16-14(17)12-8-10-6-4-3-5-7-11(10)20-12/h8-9,13H,3-7H2,1-2H3,(H,16,17)(H,18,19)/p-1/t13-/m0/s1