methyl 3-[(2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[(2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)carbamoyl]-5-nitro-benzoate CAS Name: 3-[[(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)amino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)carbamoyl]-5-nitrobenzoate Traditional Name: 3-[(3-keto-2-methyl-4H-1,4-benzoxazin-6-yl)carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C18H15N3O7 MolecularWeight: 385.3276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C18H15N3O7/c1-9-16(22)20-14-8-12(3-4-15(14)28-9)19-17(23)10-5-11(18(24)27-2)7-13(6-10)21(25)26/h3-9H,1-2H3,(H,19,23)(H,20,22)