1-[4-[3-oxidanyl-2-[(2-oxidanyl-3-phenoxy-propyl)amino]propyl]phenyl]-3-(phenylmethyl)urea

Systemtic Name: 1-[4-[3-oxidanyl-2-[(2-oxidanyl-3-phenoxy-propyl)amino]propyl]phenyl]-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-[4-[3-hydroxy-2-[(2-hydroxy-3-phenoxy-propyl)amino]propyl]phenyl]urea CAS Name: 1-[4-[3-hydroxy-2-[(2-hydroxy-3-phenoxypropyl)amino]propyl]phenyl]-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[4-[3-hydroxy-2-[(2-hydroxy-3-phenoxypropyl)amino]propyl]phenyl]urea Traditional Name: 1-benzyl-3-[4-[3-hydroxy-2-[(2-hydroxy-3-phenoxy-propyl)amino]propyl]phenyl]urea Formula: C26H31N3O4 MolecularWeight: 449.54204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)NC2=CC=C(C=C2)CC(CO)NCC(COC3=CC=CC=C3)O

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)NC2=CC=C(C=C2)CC(CO)NCC(COC3=CC=CC=C3)O

InChI

InChI=1S/C26H31N3O4/c30-18-23(27-17-24(31)19-33-25-9-5-2-6-10-25)15-20-11-13-22(14-12-20)29-26(32)28-16-21-7-3-1-4-8-21/h1-14,23-24,27,30-31H,15-19H2,(H2,28,29,32)