(2S)-4-methyl-2-(4,5,6,7-tetrahydro-1-benzothiophen-2-ylcarbonylamino)pentanoate

Systemtic Name: (2S)-4-methyl-2-(4,5,6,7-tetrahydro-1-benzothiophen-2-ylcarbonylamino)pentanoate Openeye Name: (2S)-4-methyl-2-(4,5,6,7-tetrahydrobenzothiophene-2-carbonylamino)pentanoate CAS Name: (2S)-4-methyl-2-[[oxo(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methyl]amino]pentanoate IUPAC Name: (2S)-4-methyl-2-(4,5,6,7-tetrahydro-1-benzothiophene-2-carbonylamino)pentanoate Traditional Name: (2S)-4-methyl-2-(4,5,6,7-tetrahydrobenzothiophene-2-carbonylamino)valerate Formula: C15H20NO3S- MolecularWeight: 294.3892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[O-])NC(=O)C1=CC2=C(S1)CCCC2

Isomeric SMILES

CC(C)C[C@@H](C(=O)[O-])NC(=O)C1=CC2=C(S1)CCCC2

InChI

InChI=1S/C15H21NO3S/c1-9(2)7-11(15(18)19)16-14(17)13-8-10-5-3-4-6-12(10)20-13/h8-9,11H,3-7H2,1-2H3,(H,16,17)(H,18,19)/p-1/t11-/m0/s1