N'-[2-[cyclohex-2-en-1-yl-(4-phenylmethoxyphenyl)amino]ethyl]-2-methyl-pentanediamide

Systemtic Name: N'-[2-[cyclohex-2-en-1-yl-(4-phenylmethoxyphenyl)amino]ethyl]-2-methyl-pentanediamide Openeye Name: N'-[2-(4-benzyloxy-N-cyclohex-2-en-1-yl-anilino)ethyl]-2-methyl-pentanediamide CAS Name: N'-[2-[N-(1-cyclohex-2-enyl)-4-phenylmethoxyanilino]ethyl]-2-methylpentanediamide IUPAC Name: N'-[2-(N-cyclohex-2-en-1-yl-4-phenylmethoxyanilino)ethyl]-2-methylpentanediamide Traditional Name: N'-[2-(4-benzoxy-N-cyclohex-2-en-1-yl-anilino)ethyl]-2-methyl-glutaramide Formula: C27H35N3O3 MolecularWeight: 449.5851

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)NCCN(C1CCCC=C1)C2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)N

Isomeric SMILES

CC(CCC(=O)NCCN(C1CCCC=C1)C2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C27H35N3O3/c1-21(27(28)32)12-17-26(31)29-18-19-30(23-10-6-3-7-11-23)24-13-15-25(16-14-24)33-20-22-8-4-2-5-9-22/h2,4-6,8-10,13-16,21,23H,3,7,11-12,17-20H2,1H3,(H2,28,32)(H,29,31)