1-[(5-methoxy-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-(2-methylphenyl)urea

Systemtic Name: 1-[(5-methoxy-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-(2-methylphenyl)urea Openeye Name: 1-[(5-methoxy-3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-(o-tolyl)urea CAS Name: 1-[(5-methoxy-3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-3-(2-methylphenyl)urea IUPAC Name: 1-[(5-methoxy-3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-3-(2-methylphenyl)urea Traditional Name: 1-[(6-keto-5-methoxy-3-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-(o-tolyl)urea Formula: C16H16N4O5 MolecularWeight: 344.32204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)NNC=C2C=C(C=C(C2=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1NC(=O)NNC=C2C=C(C=C(C2=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C16H16N4O5/c1-10-5-3-4-6-13(10)18-16(22)19-17-9-11-7-12(20(23)24)8-14(25-2)15(11)21/h3-9,17H,1-2H3,(H2,18,19,22)