N-(3-chlorophenyl)-2-methyl-4-[3-methyl-2-(nonanoylamino)pentanoyl]piperazine-1-carboxamide

Systemtic Name: N-(3-chlorophenyl)-2-methyl-4-[3-methyl-2-(nonanoylamino)pentanoyl]piperazine-1-carboxamide Openeye Name: N-(3-chlorophenyl)-2-methyl-4-[3-methyl-2-(nonanoylamino)pentanoyl]piperazine-1-carboxamide CAS Name: N-(3-chlorophenyl)-2-methyl-4-[3-methyl-1-oxo-2-(1-oxononylamino)pentyl]-1-piperazinecarboxamide IUPAC Name: N-(3-chlorophenyl)-2-methyl-4-[3-methyl-2-(nonanoylamino)pentanoyl]piperazine-1-carboxamide Traditional Name: N-(3-chlorophenyl)-2-methyl-4-[3-methyl-2-(pelargonylamino)pentanoyl]piperazine-1-carboxamide Formula: C27H43ClN4O3 MolecularWeight: 507.10832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)NC(C(C)CC)C(=O)N1CCN(C(C1)C)C(=O)NC2=CC(=CC=C2)Cl

Isomeric SMILES

CCCCCCCCC(=O)NC(C(C)CC)C(=O)N1CCN(C(C1)C)C(=O)NC2=CC(=CC=C2)Cl

InChI

InChI=1S/C27H43ClN4O3/c1-5-7-8-9-10-11-15-24(33)30-25(20(3)6-2)26(34)31-16-17-32(21(4)19-31)27(35)29-23-14-12-13-22(28)18-23/h12-14,18,20-21,25H,5-11,15-17,19H2,1-4H3,(H,29,35)(H,30,33)