4-[2-(6-chloranyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoylamino]-3-methyl-benzoic acid

Systemtic Name: 4-[2-(6-chloranyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoylamino]-3-methyl-benzoic acid Openeye Name: 4-[[2-(6-chloro-3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]-3-methyl-benzoic acid CAS Name: 4-[[2-(6-chloro-3-oxo-1,4-benzoxazin-4-yl)-1-oxoethyl]amino]-3-methylbenzoic acid IUPAC Name: 4-[[2-(6-chloro-3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]-3-methylbenzoic acid Traditional Name: 4-[[2-(6-chloro-3-keto-1,4-benzoxazin-4-yl)acetyl]amino]-3-methyl-benzoic acid Formula: C18H15ClN2O5 MolecularWeight: 374.7751

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC(=O)CN2C(=O)COC3=C2C=C(C=C3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC(=O)CN2C(=O)COC3=C2C=C(C=C3)Cl

InChI

InChI=1S/C18H15ClN2O5/c1-10-6-11(18(24)25)2-4-13(10)20-16(22)8-21-14-7-12(19)3-5-15(14)26-9-17(21)23/h2-7H,8-9H2,1H3,(H,20,22)(H,24,25)