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

Systemtic Name: (2S)-4-methyl-2-[(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]pentanoic acid Openeye Name: (2S)-4-methyl-2-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]pentanoic acid CAS Name: (2S)-4-methyl-2-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]pentanoic acid IUPAC Name: (2S)-4-methyl-2-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]pentanoic acid Traditional Name: (2S)-2-[(2-keto-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]-4-methyl-valeric acid Formula: C16H22N2O5S MolecularWeight: 354.42128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O5S/c1-10(2)8-14(16(20)21)18-24(22,23)12-6-7-13-11(9-12)4-3-5-15(19)17-13/h6-7,9-10,14,18H,3-5,8H2,1-2H3,(H,17,19)(H,20,21)/t14-/m0/s1