1-[1-(1,3-benzodioxol-5-ylmethyl)piperidin-4-yl]-3-[(3-methoxyphenyl)methyl]urea

Systemtic Name: 1-[1-(1,3-benzodioxol-5-ylmethyl)piperidin-4-yl]-3-[(3-methoxyphenyl)methyl]urea Openeye Name: 1-[1-(1,3-benzodioxol-5-ylmethyl)-4-piperidyl]-3-[(3-methoxyphenyl)methyl]urea CAS Name: 1-[1-(1,3-benzodioxol-5-ylmethyl)-4-piperidinyl]-3-[(3-methoxyphenyl)methyl]urea IUPAC Name: 1-[1-(1,3-benzodioxol-5-ylmethyl)piperidin-4-yl]-3-[(3-methoxyphenyl)methyl]urea Traditional Name: 1-m-anisyl-3-(1-piperonyl-4-piperidyl)urea Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC(=O)NC2CCN(CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=CC=CC(=C1)CNC(=O)NC2CCN(CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H27N3O4/c1-27-19-4-2-3-16(11-19)13-23-22(26)24-18-7-9-25(10-8-18)14-17-5-6-20-21(12-17)29-15-28-20/h2-6,11-12,18H,7-10,13-15H2,1H3,(H2,23,24,26)