1,1-bis(2-chloroethyl)-3-(4-nitrophenyl)urea

Systemtic Name: 1,1-bis(2-chloroethyl)-3-(4-nitrophenyl)urea Openeye Name: 1,1-bis(2-chloroethyl)-3-(4-nitrophenyl)urea CAS Name: 1,1-bis(2-chloroethyl)-3-(4-nitrophenyl)urea IUPAC Name: 1,1-bis(2-chloroethyl)-3-(4-nitrophenyl)urea Traditional Name: 1,1-bis(2-chloroethyl)-3-(4-nitrophenyl)urea Formula: C11H13Cl2N3O3 MolecularWeight: 306.14522

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)N(CCCl)CCCl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=O)N(CCCl)CCCl)[N+](=O)[O-]

InChI

InChI=1S/C11H13Cl2N3O3/c12-5-7-15(8-6-13)11(17)14-9-1-3-10(4-2-9)16(18)19/h1-4H,5-8H2,(H,14,17)