1-[4-[2-(4-chlorophenyl)ethyl-ethyl-amino]butyl]-3-(4-nitrophenyl)urea

Systemtic Name: 1-[4-[2-(4-chlorophenyl)ethyl-ethyl-amino]butyl]-3-(4-nitrophenyl)urea Openeye Name: 1-[4-[2-(4-chlorophenyl)ethyl-ethyl-amino]butyl]-3-(4-nitrophenyl)urea CAS Name: 1-[4-[2-(4-chlorophenyl)ethyl-ethylamino]butyl]-3-(4-nitrophenyl)urea IUPAC Name: 1-[4-[2-(4-chlorophenyl)ethyl-ethylamino]butyl]-3-(4-nitrophenyl)urea Traditional Name: 1-[4-[2-(4-chlorophenyl)ethyl-ethyl-amino]butyl]-3-(4-nitrophenyl)urea Formula: C21H27ClN4O3 MolecularWeight: 418.91708

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCCNC(=O)NC1=CC=C(C=C1)[N+](=O)[O-])CCC2=CC=C(C=C2)Cl

Isomeric SMILES

CCN(CCCCNC(=O)NC1=CC=C(C=C1)[N+](=O)[O-])CCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H27ClN4O3/c1-2-25(16-13-17-5-7-18(22)8-6-17)15-4-3-14-23-21(27)24-19-9-11-20(12-10-19)26(28)29/h5-12H,2-4,13-16H2,1H3,(H2,23,24,27)