1-[2-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanyl-propoxy]phenyl]-3-methyl-urea

Systemtic Name: 1-[2-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanyl-propoxy]phenyl]-3-methyl-urea Openeye Name: 1-[2-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxy-propoxy]phenyl]-3-methyl-urea CAS Name: 1-[2-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxypropoxy]phenyl]-3-methylurea IUPAC Name: 1-[2-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxypropoxy]phenyl]-3-methylurea Traditional Name: 1-[2-[3-(homoveratrylamino)-2-hydroxy-propoxy]phenyl]-3-methyl-urea Formula: C21H29N3O5 MolecularWeight: 403.47206

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC1=CC=CC=C1OCC(CNCCC2=CC(=C(C=C2)OC)OC)O

Isomeric SMILES

CNC(=O)NC1=CC=CC=C1OCC(CNCCC2=CC(=C(C=C2)OC)OC)O

InChI

InChI=1S/C21H29N3O5/c1-22-21(26)24-17-6-4-5-7-18(17)29-14-16(25)13-23-11-10-15-8-9-19(27-2)20(12-15)28-3/h4-9,12,16,23,25H,10-11,13-14H2,1-3H3,(H2,22,24,26)