1-[[2-azanyl-3-(2,6-dimethyl-4-oxidanyl-phenyl)propanoyl]amino]-N-(3-phenylpropyl)cyclohexane-1-carboxamide

Systemtic Name: 1-[[2-azanyl-3-(2,6-dimethyl-4-oxidanyl-phenyl)propanoyl]amino]-N-(3-phenylpropyl)cyclohexane-1-carboxamide Openeye Name: 1-[[2-amino-3-(4-hydroxy-2,6-dimethyl-phenyl)propanoyl]amino]-N-(3-phenylpropyl)cyclohexanecarboxamide CAS Name: 1-[[2-amino-3-(4-hydroxy-2,6-dimethylphenyl)-1-oxopropyl]amino]-N-(3-phenylpropyl)-1-cyclohexanecarboxamide IUPAC Name: 1-[[2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]amino]-N-(3-phenylpropyl)cyclohexane-1-carboxamide Traditional Name: 1-[[2-amino-3-(4-hydroxy-2,6-dimethyl-phenyl)propanoyl]amino]-N-(3-phenylpropyl)cyclohexanecarboxamide Formula: C27H37N3O3 MolecularWeight: 451.60098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CC(C(=O)NC2(CCCCC2)C(=O)NCCCC3=CC=CC=C3)N)C)O

Isomeric SMILES

CC1=CC(=CC(=C1CC(C(=O)NC2(CCCCC2)C(=O)NCCCC3=CC=CC=C3)N)C)O

InChI

InChI=1S/C27H37N3O3/c1-19-16-22(31)17-20(2)23(19)18-24(28)25(32)30-27(13-7-4-8-14-27)26(33)29-15-9-12-21-10-5-3-6-11-21/h3,5-6,10-11,16-17,24,31H,4,7-9,12-15,18,28H2,1-2H3,(H,29,33)(H,30,32)