1-butyl-1-[(3E)-4-methylhexa-3,5-dienyl]-3-(4-nitrophenyl)urea

Systemtic Name: 1-butyl-1-[(3E)-4-methylhexa-3,5-dienyl]-3-(4-nitrophenyl)urea Openeye Name: 1-butyl-1-[(3E)-4-methylhexa-3,5-dienyl]-3-(4-nitrophenyl)urea CAS Name: 1-butyl-1-[(3E)-4-methylhexa-3,5-dienyl]-3-(4-nitrophenyl)urea IUPAC Name: 1-butyl-1-[(3E)-4-methylhexa-3,5-dienyl]-3-(4-nitrophenyl)urea Traditional Name: 1-butyl-1-[(3E)-4-methylhexa-3,5-dienyl]-3-(4-nitrophenyl)urea Formula: C18H25N3O3 MolecularWeight: 331.4094

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCC=C(C)C=C)C(=O)NC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CC/C=C(\C)/C=C)C(=O)NC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C18H25N3O3/c1-4-6-13-20(14-7-8-15(3)5-2)18(22)19-16-9-11-17(12-10-16)21(23)24/h5,8-12H,2,4,6-7,13-14H2,1,3H3,(H,19,22)/b15-8+