N-[5-[3-(aminocarbonylamino)propyl]-2-tert-butyl-phenyl]-3-(2,4-dimethoxyphenyl)octanamide

Systemtic Name: N-[5-[3-(aminocarbonylamino)propyl]-2-tert-butyl-phenyl]-3-(2,4-dimethoxyphenyl)octanamide Openeye Name: N-[2-tert-butyl-5-(3-ureidopropyl)phenyl]-3-(2,4-dimethoxyphenyl)octanamide CAS Name: N-[2-tert-butyl-5-[3-(carbamoylamino)propyl]phenyl]-3-(2,4-dimethoxyphenyl)octanamide IUPAC Name: N-[2-tert-butyl-5-[3-(carbamoylamino)propyl]phenyl]-3-(2,4-dimethoxyphenyl)octanamide Traditional Name: N-[2-tert-butyl-5-(3-ureidopropyl)phenyl]-3-(2,4-dimethoxyphenyl)caprylamide Formula: C30H45N3O4 MolecularWeight: 511.696

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC(=O)NC1=C(C=CC(=C1)CCCNC(=O)N)C(C)(C)C)C2=C(C=C(C=C2)OC)OC

Isomeric SMILES

CCCCCC(CC(=O)NC1=C(C=CC(=C1)CCCNC(=O)N)C(C)(C)C)C2=C(C=C(C=C2)OC)OC

InChI

InChI=1S/C30H45N3O4/c1-7-8-9-12-22(24-15-14-23(36-5)20-27(24)37-6)19-28(34)33-26-18-21(11-10-17-32-29(31)35)13-16-25(26)30(2,3)4/h13-16,18,20,22H,7-12,17,19H2,1-6H3,(H,33,34)(H3,31,32,35)