4-[(6-chloranyl-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl)carbonylamino]benzoic acid

Systemtic Name: 4-[(6-chloranyl-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl)carbonylamino]benzoic acid Openeye Name: 4-[(6-chloro-2-ethyl-2,3-dihydro-1,4-benzoxazine-4-carbonyl)amino]benzoic acid CAS Name: 4-[[(6-chloro-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl)-oxomethyl]amino]benzoic acid IUPAC Name: 4-[(6-chloro-2-ethyl-2,3-dihydro-1,4-benzoxazine-4-carbonyl)amino]benzoic acid Traditional Name: 4-[(6-chloro-2-ethyl-2,3-dihydro-1,4-benzoxazine-4-carbonyl)amino]benzoic acid Formula: C18H17ClN2O4 MolecularWeight: 360.79158

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(C2=C(O1)C=CC(=C2)Cl)C(=O)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCC1CN(C2=C(O1)C=CC(=C2)Cl)C(=O)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C18H17ClN2O4/c1-2-14-10-21(15-9-12(19)5-8-16(15)25-14)18(24)20-13-6-3-11(4-7-13)17(22)23/h3-9,14H,2,10H2,1H3,(H,20,24)(H,22,23)