(2S)-3-methyl-2-[(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]butanoic acid

Systemtic Name: (2S)-3-methyl-2-[(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]butanoic acid Openeye Name: (2S)-3-methyl-2-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]butanoic acid CAS Name: (2S)-3-methyl-2-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]butanoic acid IUPAC Name: (2S)-3-methyl-2-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]butanoic acid Traditional Name: (2S)-2-[(2-keto-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]-3-methyl-butyric acid Formula: C15H20N2O5S MolecularWeight: 340.3947

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NS(=O)(=O)C1=CC2=C(C=C1)NC(=O)CCC2

Isomeric SMILES

CC(C)[C@@H](C(=O)O)NS(=O)(=O)C1=CC2=C(C=C1)NC(=O)CCC2

InChI

InChI=1S/C15H20N2O5S/c1-9(2)14(15(19)20)17-23(21,22)11-6-7-12-10(8-11)4-3-5-13(18)16-12/h6-9,14,17H,3-5H2,1-2H3,(H,16,18)(H,19,20)/t14-/m0/s1