N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-pyrrolidin-1-ylcarbonyl-phenyl]-3,5,5-trimethyl-hexanamide

Systemtic Name: N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-pyrrolidin-1-ylcarbonyl-phenyl]-3,5,5-trimethyl-hexanamide Openeye Name: N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(pyrrolidine-1-carbonyl)phenyl]-3,5,5-trimethyl-hexanamide CAS Name: N-[4-[4-(2-methoxyphenyl)-1-piperazinyl]-3-[oxo(1-pyrrolidinyl)methyl]phenyl]-3,5,5-trimethylhexanamide IUPAC Name: N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(pyrrolidine-1-carbonyl)phenyl]-3,5,5-trimethylhexanamide Traditional Name: N-[4-[4-(2-methoxyphenyl)piperazino]-3-(pyrrolidine-1-carbonyl)phenyl]-3,5,5-trimethyl-hexanamide Formula: C31H44N4O3 MolecularWeight: 520.70606

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=CC=CC=C3OC)C(=O)N4CCCC4)CC(C)(C)C

Isomeric SMILES

CC(CC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=CC=CC=C3OC)C(=O)N4CCCC4)CC(C)(C)C

InChI

InChI=1S/C31H44N4O3/c1-23(22-31(2,3)4)20-29(36)32-24-12-13-26(25(21-24)30(37)35-14-8-9-15-35)33-16-18-34(19-17-33)27-10-6-7-11-28(27)38-5/h6-7,10-13,21,23H,8-9,14-20,22H2,1-5H3,(H,32,36)