1-(3-methyl-2-morpholin-4-yl-butyl)-3-[2-[(4-nitrophenyl)amino]ethyl]urea

Systemtic Name: 1-(3-methyl-2-morpholin-4-yl-butyl)-3-[2-[(4-nitrophenyl)amino]ethyl]urea Openeye Name: 1-(3-methyl-2-morpholino-butyl)-3-[2-(4-nitroanilino)ethyl]urea CAS Name: 1-[3-methyl-2-(4-morpholinyl)butyl]-3-[2-(4-nitroanilino)ethyl]urea IUPAC Name: 1-(3-methyl-2-morpholin-4-ylbutyl)-3-[2-(4-nitroanilino)ethyl]urea Traditional Name: 1-(3-methyl-2-morpholino-butyl)-3-[2-(4-nitroanilino)ethyl]urea Formula: C18H29N5O4 MolecularWeight: 379.45396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CNC(=O)NCCNC1=CC=C(C=C1)[N+](=O)[O-])N2CCOCC2

Isomeric SMILES

CC(C)C(CNC(=O)NCCNC1=CC=C(C=C1)[N+](=O)[O-])N2CCOCC2

InChI

InChI=1S/C18H29N5O4/c1-14(2)17(22-9-11-27-12-10-22)13-21-18(24)20-8-7-19-15-3-5-16(6-4-15)23(25)26/h3-6,14,17,19H,7-13H2,1-2H3,(H2,20,21,24)