2-[7-(4-methylpiperidin-1-yl)sulfonyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl]ethanoic acid

Systemtic Name: 2-[7-(4-methylpiperidin-1-yl)sulfonyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl]ethanoic acid Openeye Name: 2-[7-[(4-methyl-1-piperidyl)sulfonyl]-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid CAS Name: 2-[7-[(4-methyl-1-piperidinyl)sulfonyl]-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid IUPAC Name: 2-[7-(4-methylpiperidin-1-yl)sulfonyl-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid Traditional Name: 2-[2-keto-7-(4-methylpiperidino)sulfonyl-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid Formula: C18H24N2O5S MolecularWeight: 380.45856

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)CCC3)CC(=O)O

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)CCC3)CC(=O)O

InChI

InChI=1S/C18H24N2O5S/c1-13-7-9-19(10-8-13)26(24,25)15-5-6-16-14(11-15)3-2-4-17(21)20(16)12-18(22)23/h5-6,11,13H,2-4,7-10,12H2,1H3,(H,22,23)