1-(3,4-dichlorophenyl)-3-(7-nitro-6-oxidanylidene-heptyl)urea

Systemtic Name: 1-(3,4-dichlorophenyl)-3-(7-nitro-6-oxidanylidene-heptyl)urea Openeye Name: 1-(3,4-dichlorophenyl)-3-(7-nitro-6-oxo-heptyl)urea CAS Name: 1-(3,4-dichlorophenyl)-3-(7-nitro-6-oxoheptyl)urea IUPAC Name: 1-(3,4-dichlorophenyl)-3-(7-nitro-6-oxoheptyl)urea Traditional Name: 1-(3,4-dichlorophenyl)-3-(6-keto-7-nitro-heptyl)urea Formula: C14H17Cl2N3O4 MolecularWeight: 362.20848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)NCCCCCC(=O)C[N+](=O)[O-])Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)NCCCCCC(=O)C[N+](=O)[O-])Cl)Cl

InChI

InChI=1S/C14H17Cl2N3O4/c15-12-6-5-10(8-13(12)16)18-14(21)17-7-3-1-2-4-11(20)9-19(22)23/h5-6,8H,1-4,7,9H2,(H2,17,18,21)