3-(5-tert-butyl-1-ethanoyl-3-methoxy-6-oxidanyl-cyclohexa-2,4-dien-1-yl)-1-cycloheptyl-1-(4-dimethylaminophenyl)urea

Systemtic Name: 3-(5-tert-butyl-1-ethanoyl-3-methoxy-6-oxidanyl-cyclohexa-2,4-dien-1-yl)-1-cycloheptyl-1-(4-dimethylaminophenyl)urea Openeye Name: 3-(1-acetyl-5-tert-butyl-6-hydroxy-3-methoxy-cyclohexa-2,4-dien-1-yl)-1-cycloheptyl-1-(4-dimethylaminophenyl)urea CAS Name: 3-(1-acetyl-5-tert-butyl-6-hydroxy-3-methoxy-1-cyclohexa-2,4-dienyl)-1-cycloheptyl-1-(4-dimethylaminophenyl)urea IUPAC Name: 3-(1-acetyl-5-tert-butyl-6-hydroxy-3-methoxycyclohexa-2,4-dien-1-yl)-1-cycloheptyl-1-(4-dimethylaminophenyl)urea Traditional Name: 3-(1-acetyl-5-tert-butyl-6-hydroxy-3-methoxy-cyclohexa-2,4-dien-1-yl)-1-cycloheptyl-1-(4-dimethylaminophenyl)urea Formula: C29H43N3O4 MolecularWeight: 497.66942

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(C=C(C=C(C1O)C(C)(C)C)OC)NC(=O)N(C2CCCCCC2)C3=CC=C(C=C3)N(C)C

Isomeric SMILES

CC(=O)C1(C=C(C=C(C1O)C(C)(C)C)OC)NC(=O)N(C2CCCCCC2)C3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C29H43N3O4/c1-20(33)29(19-24(36-7)18-25(26(29)34)28(2,3)4)30-27(35)32(22-12-10-8-9-11-13-22)23-16-14-21(15-17-23)31(5)6/h14-19,22,26,34H,8-13H2,1-7H3,(H,30,35)