1-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-(3-methylphenyl)urea

Systemtic Name: 1-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-(3-methylphenyl)urea Openeye Name: 1-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-(m-tolyl)urea CAS Name: 1-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-3-(3-methylphenyl)urea IUPAC Name: 1-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-3-(3-methylphenyl)urea Traditional Name: 1-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-(m-tolyl)urea Formula: C18H21N3O5 MolecularWeight: 359.37644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NCCC2=CC(=C(C=C2[N+](=O)[O-])OC)OC

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NCCC2=CC(=C(C=C2[N+](=O)[O-])OC)OC

InChI

InChI=1S/C18H21N3O5/c1-12-5-4-6-14(9-12)20-18(22)19-8-7-13-10-16(25-2)17(26-3)11-15(13)21(23)24/h4-6,9-11H,7-8H2,1-3H3,(H2,19,20,22)