1-(2-methoxy-4-nitro-phenyl)-3-(3-methylbutyl)urea

Systemtic Name: 1-(2-methoxy-4-nitro-phenyl)-3-(3-methylbutyl)urea Openeye Name: 1-isopentyl-3-(2-methoxy-4-nitro-phenyl)urea CAS Name: 1-(2-methoxy-4-nitrophenyl)-3-(3-methylbutyl)urea IUPAC Name: 1-(2-methoxy-4-nitrophenyl)-3-(3-methylbutyl)urea Traditional Name: 1-isoamyl-3-(2-methoxy-4-nitro-phenyl)urea Formula: C13H19N3O4 MolecularWeight: 281.30766

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])OC

Isomeric SMILES

CC(C)CCNC(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])OC

InChI

InChI=1S/C13H19N3O4/c1-9(2)6-7-14-13(17)15-11-5-4-10(16(18)19)8-12(11)20-3/h4-5,8-9H,6-7H2,1-3H3,(H2,14,15,17)