6-[(2-chloranyl-4-nitro-phenyl)amino]-1,4,4-trimethyl-3,1-benzoxazin-2-one

Systemtic Name: 6-[(2-chloranyl-4-nitro-phenyl)amino]-1,4,4-trimethyl-3,1-benzoxazin-2-one Openeye Name: 6-(2-chloro-4-nitro-anilino)-1,4,4-trimethyl-3,1-benzoxazin-2-one CAS Name: 6-(2-chloro-4-nitroanilino)-1,4,4-trimethyl-3,1-benzoxazin-2-one IUPAC Name: 6-(2-chloro-4-nitroanilino)-1,4,4-trimethyl-3,1-benzoxazin-2-one Traditional Name: 6-(2-chloro-4-nitro-anilino)-1,4,4-trimethyl-3,1-benzoxazin-2-one Formula: C17H16ClN3O4 MolecularWeight: 361.77964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2)NC3=C(C=C(C=C3)[N+](=O)[O-])Cl)N(C(=O)O1)C)C

Isomeric SMILES

CC1(C2=C(C=CC(=C2)NC3=C(C=C(C=C3)[N+](=O)[O-])Cl)N(C(=O)O1)C)C

InChI

InChI=1S/C17H16ClN3O4/c1-17(2)12-8-10(4-7-15(12)20(3)16(22)25-17)19-14-6-5-11(21(23)24)9-13(14)18/h4-9,19H,1-3H3