1-[2-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethyl]-6-methoxy-phenyl]-3-[1-(phenylmethyl)piperidin-4-yl]urea

Systemtic Name: 1-[2-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethyl]-6-methoxy-phenyl]-3-[1-(phenylmethyl)piperidin-4-yl]urea Openeye Name: 1-(1-benzyl-4-piperidyl)-3-[2-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethyl]-6-methoxy-phenyl]urea CAS Name: 1-[2-[2-(3,5-ditert-butyl-4-hydroxyphenyl)ethyl]-6-methoxyphenyl]-3-[1-(phenylmethyl)-4-piperidinyl]urea IUPAC Name: 1-(1-benzylpiperidin-4-yl)-3-[2-[2-(3,5-ditert-butyl-4-hydroxyphenyl)ethyl]-6-methoxyphenyl]urea Traditional Name: 1-(1-benzyl-4-piperidyl)-3-[2-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethyl]-6-methoxy-phenyl]urea Formula: C36H49N3O3 MolecularWeight: 571.79256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC2=C(C(=CC=C2)OC)NC(=O)NC3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC2=C(C(=CC=C2)OC)NC(=O)NC3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C36H49N3O3/c1-35(2,3)29-22-26(23-30(33(29)40)36(4,5)6)16-17-27-14-11-15-31(42-7)32(27)38-34(41)37-28-18-20-39(21-19-28)24-25-12-9-8-10-13-25/h8-15,22-23,28,40H,16-21,24H2,1-7H3,(H2,37,38,41)