N-[2-tert-butyl-5-(4-methylpiperazin-1-yl)carbonyl-phenyl]-3-(2-methoxy-4-methyl-phenyl)octanamide

Systemtic Name: N-[2-tert-butyl-5-(4-methylpiperazin-1-yl)carbonyl-phenyl]-3-(2-methoxy-4-methyl-phenyl)octanamide Openeye Name: N-[2-tert-butyl-5-(4-methylpiperazine-1-carbonyl)phenyl]-3-(2-methoxy-4-methyl-phenyl)octanamide CAS Name: N-[2-tert-butyl-5-[(4-methyl-1-piperazinyl)-oxomethyl]phenyl]-3-(2-methoxy-4-methylphenyl)octanamide IUPAC Name: N-[2-tert-butyl-5-(4-methylpiperazine-1-carbonyl)phenyl]-3-(2-methoxy-4-methylphenyl)octanamide Traditional Name: N-[2-tert-butyl-5-(4-methylpiperazine-1-carbonyl)phenyl]-3-(2-methoxy-4-methyl-phenyl)caprylamide Formula: C32H47N3O3 MolecularWeight: 521.73388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC(=O)NC1=C(C=CC(=C1)C(=O)N2CCN(CC2)C)C(C)(C)C)C3=C(C=C(C=C3)C)OC

Isomeric SMILES

CCCCCC(CC(=O)NC1=C(C=CC(=C1)C(=O)N2CCN(CC2)C)C(C)(C)C)C3=C(C=C(C=C3)C)OC

InChI

InChI=1S/C32H47N3O3/c1-8-9-10-11-24(26-14-12-23(2)20-29(26)38-7)22-30(36)33-28-21-25(13-15-27(28)32(3,4)5)31(37)35-18-16-34(6)17-19-35/h12-15,20-21,24H,8-11,16-19,22H2,1-7H3,(H,33,36)