3-[2-[3,4-bis(oxidanyl)phenyl]ethylamino]-1-hexyl-1-phenyl-urea

Systemtic Name: 3-[2-[3,4-bis(oxidanyl)phenyl]ethylamino]-1-hexyl-1-phenyl-urea Openeye Name: 3-[2-(3,4-dihydroxyphenyl)ethylamino]-1-hexyl-1-phenyl-urea CAS Name: 3-[2-(3,4-dihydroxyphenyl)ethylamino]-1-hexyl-1-phenylurea IUPAC Name: 3-[2-(3,4-dihydroxyphenyl)ethylamino]-1-hexyl-1-phenylurea Traditional Name: 3-[2-(3,4-dihydroxyphenyl)ethylamino]-1-hexyl-1-phenyl-urea Formula: C21H29N3O3 MolecularWeight: 371.47326

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(C1=CC=CC=C1)C(=O)NNCCC2=CC(=C(C=C2)O)O

Isomeric SMILES

CCCCCCN(C1=CC=CC=C1)C(=O)NNCCC2=CC(=C(C=C2)O)O

InChI

InChI=1S/C21H29N3O3/c1-2-3-4-8-15-24(18-9-6-5-7-10-18)21(27)23-22-14-13-17-11-12-19(25)20(26)16-17/h5-7,9-12,16,22,25-26H,2-4,8,13-15H2,1H3,(H,23,27)