1-(1-adamantyl)-1-[(3,4-dimethoxyphenyl)methyl]-3-(3-methylphenyl)urea

Systemtic Name: 1-(1-adamantyl)-1-[(3,4-dimethoxyphenyl)methyl]-3-(3-methylphenyl)urea Openeye Name: 1-(1-adamantyl)-1-[(3,4-dimethoxyphenyl)methyl]-3-(m-tolyl)urea CAS Name: 1-(1-adamantyl)-1-[(3,4-dimethoxyphenyl)methyl]-3-(3-methylphenyl)urea IUPAC Name: 1-(1-adamantyl)-1-[(3,4-dimethoxyphenyl)methyl]-3-(3-methylphenyl)urea Traditional Name: 1-(1-adamantyl)-3-(m-tolyl)-1-veratryl-urea Formula: C27H34N2O3 MolecularWeight: 434.57046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)N(CC2=CC(=C(C=C2)OC)OC)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)N(CC2=CC(=C(C=C2)OC)OC)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C27H34N2O3/c1-18-5-4-6-23(9-18)28-26(30)29(17-19-7-8-24(31-2)25(13-19)32-3)27-14-20-10-21(15-27)12-22(11-20)16-27/h4-9,13,20-22H,10-12,14-17H2,1-3H3,(H,28,30)