3-[(4-ethanoyl-2-methyl-2,3-dihydro-1,4-benzoxazin-6-yl)sulfonylamino]-3-(2-methylphenyl)propanoic acid

Systemtic Name: 3-[(4-ethanoyl-2-methyl-2,3-dihydro-1,4-benzoxazin-6-yl)sulfonylamino]-3-(2-methylphenyl)propanoic acid Openeye Name: 3-[(4-acetyl-2-methyl-2,3-dihydro-1,4-benzoxazin-6-yl)sulfonylamino]-3-(o-tolyl)propanoic acid CAS Name: 3-[(4-acetyl-2-methyl-2,3-dihydro-1,4-benzoxazin-6-yl)sulfonylamino]-3-(2-methylphenyl)propanoic acid IUPAC Name: 3-[(4-acetyl-2-methyl-2,3-dihydro-1,4-benzoxazin-6-yl)sulfonylamino]-3-(2-methylphenyl)propanoic acid Traditional Name: 3-[(4-acetyl-2-methyl-2,3-dihydro-1,4-benzoxazin-6-yl)sulfonylamino]-3-(o-tolyl)propionic acid Formula: C21H24N2O6S MolecularWeight: 432.49006

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C2=C(O1)C=CC(=C2)S(=O)(=O)NC(CC(=O)O)C3=CC=CC=C3C)C(=O)C

Isomeric SMILES

CC1CN(C2=C(O1)C=CC(=C2)S(=O)(=O)NC(CC(=O)O)C3=CC=CC=C3C)C(=O)C

InChI

InChI=1S/C21H24N2O6S/c1-13-6-4-5-7-17(13)18(11-21(25)26)22-30(27,28)16-8-9-20-19(10-16)23(15(3)24)12-14(2)29-20/h4-10,14,18,22H,11-12H2,1-3H3,(H,25,26)