4-(6-chloranyl-4-oxidanylidene-2H-1,3-benzoxazin-3-yl)butanoic acid; naphthalene

Systemtic Name: 4-(6-chloranyl-4-oxidanylidene-2H-1,3-benzoxazin-3-yl)butanoic acid; naphthalene Openeye Name: 4-(6-chloro-4-oxo-2H-1,3-benzoxazin-3-yl)butanoic acid; naphthalene CAS Name: 4-(6-chloro-4-oxo-2H-1,3-benzoxazin-3-yl)butanoic acid; naphthalene IUPAC Name: 4-(6-chloro-4-oxo-2H-1,3-benzoxazin-3-yl)butanoic acid; naphthalene Traditional Name: 4-(6-chloro-4-keto-2H-1,3-benzoxazin-3-yl)butyric acid; naphthalene Formula: C22H20ClNO4 MolecularWeight: 397.8515

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1N(C(=O)C2=C(O1)C=CC(=C2)Cl)CCCC(=O)O.C1=CC=C2C=CC=CC2=C1

Isomeric SMILES

C1N(C(=O)C2=C(O1)C=CC(=C2)Cl)CCCC(=O)O.C1=CC=C2C=CC=CC2=C1

InChI

InChI=1S/C12H12ClNO4.C10H8/c13-8-3-4-10-9(6-8)12(17)14(7-18-10)5-1-2-11(15)16;1-2-6-10-8-4-3-7-9(10)5-1/h3-4,6H,1-2,5,7H2,(H,15,16);1-8H