2-[methyl-[(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]amino]ethanoic acid

Systemtic Name: 2-[methyl-[(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]amino]ethanoic acid Openeye Name: 2-[methyl-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]amino]acetic acid CAS Name: 2-[methyl-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]amino]acetic acid IUPAC Name: 2-[methyl-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]amino]acetic acid Traditional Name: 2-[(2-keto-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl-methyl-amino]acetic acid Formula: C13H16N2O5S MolecularWeight: 312.34154

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)S(=O)(=O)C1=CC2=C(C=C1)NC(=O)CCC2

Isomeric SMILES

CN(CC(=O)O)S(=O)(=O)C1=CC2=C(C=C1)NC(=O)CCC2

InChI

InChI=1S/C13H16N2O5S/c1-15(8-13(17)18)21(19,20)10-5-6-11-9(7-10)3-2-4-12(16)14-11/h5-7H,2-4,8H2,1H3,(H,14,16)(H,17,18)