3-(4-chlorophenyl)-1-cyclopentyl-1-[(2,3,4-trimethoxyphenyl)methyl]urea

Systemtic Name: 3-(4-chlorophenyl)-1-cyclopentyl-1-[(2,3,4-trimethoxyphenyl)methyl]urea Openeye Name: 3-(4-chlorophenyl)-1-cyclopentyl-1-[(2,3,4-trimethoxyphenyl)methyl]urea CAS Name: 3-(4-chlorophenyl)-1-cyclopentyl-1-[(2,3,4-trimethoxyphenyl)methyl]urea IUPAC Name: 3-(4-chlorophenyl)-1-cyclopentyl-1-[(2,3,4-trimethoxyphenyl)methyl]urea Traditional Name: 3-(4-chlorophenyl)-1-cyclopentyl-1-(2,3,4-trimethoxybenzyl)urea Formula: C22H27ClN2O4 MolecularWeight: 418.91378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CN(C2CCCC2)C(=O)NC3=CC=C(C=C3)Cl)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CN(C2CCCC2)C(=O)NC3=CC=C(C=C3)Cl)OC)OC

InChI

InChI=1S/C22H27ClN2O4/c1-27-19-13-8-15(20(28-2)21(19)29-3)14-25(18-6-4-5-7-18)22(26)24-17-11-9-16(23)10-12-17/h8-13,18H,4-7,14H2,1-3H3,(H,24,26)