N-[2-tert-butyl-5-[(phenylcarbamoylamino)methyl]phenyl]-3-(2,3-dihydro-1,4-benzodioxin-5-yl)octanamide

Systemtic Name: N-[2-tert-butyl-5-[(phenylcarbamoylamino)methyl]phenyl]-3-(2,3-dihydro-1,4-benzodioxin-5-yl)octanamide Openeye Name: N-[2-tert-butyl-5-[(phenylcarbamoylamino)methyl]phenyl]-3-(2,3-dihydro-1,4-benzodioxin-5-yl)octanamide CAS Name: N-[5-[[[anilino(oxo)methyl]amino]methyl]-2-tert-butylphenyl]-3-(2,3-dihydro-1,4-benzodioxin-5-yl)octanamide IUPAC Name: N-[2-tert-butyl-5-[(phenylcarbamoylamino)methyl]phenyl]-3-(2,3-dihydro-1,4-benzodioxin-5-yl)octanamide Traditional Name: N-[2-tert-butyl-5-[(phenylcarbamoylamino)methyl]phenyl]-3-(2,3-dihydro-1,4-benzodioxin-5-yl)caprylamide Formula: C34H43N3O4 MolecularWeight: 557.72292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC(=O)NC1=C(C=CC(=C1)CNC(=O)NC2=CC=CC=C2)C(C)(C)C)C3=C4C(=CC=C3)OCCO4

Isomeric SMILES

CCCCCC(CC(=O)NC1=C(C=CC(=C1)CNC(=O)NC2=CC=CC=C2)C(C)(C)C)C3=C4C(=CC=C3)OCCO4

InChI

InChI=1S/C34H43N3O4/c1-5-6-8-12-25(27-15-11-16-30-32(27)41-20-19-40-30)22-31(38)37-29-21-24(17-18-28(29)34(2,3)4)23-35-33(39)36-26-13-9-7-10-14-26/h7,9-11,13-18,21,25H,5-6,8,12,19-20,22-23H2,1-4H3,(H,37,38)(H2,35,36,39)