3-[1-[[(2S)-2-acetamido-3-cyclohexa-1,5-dien-1-yl-propanoyl]amino]butyl]-2-(cyclohexylmethoxy)benzamide

Systemtic Name: 3-[1-[[(2S)-2-acetamido-3-cyclohexa-1,5-dien-1-yl-propanoyl]amino]butyl]-2-(cyclohexylmethoxy)benzamide Openeye Name: 3-[1-[[(2S)-2-acetamido-3-cyclohexa-1,5-dien-1-yl-propanoyl]amino]butyl]-2-(cyclohexylmethoxy)benzamide CAS Name: 3-[1-[[(2S)-2-acetamido-3-(1-cyclohexa-1,5-dienyl)-1-oxopropyl]amino]butyl]-2-(cyclohexylmethoxy)benzamide IUPAC Name: 3-[1-[[(2S)-2-acetamido-3-cyclohexa-1,5-dien-1-ylpropanoyl]amino]butyl]-2-(cyclohexylmethoxy)benzamide Traditional Name: 3-[1-[[(2S)-2-acetamido-3-cyclohexa-1,5-dien-1-yl-propanoyl]amino]butyl]-2-(cyclohexylmethoxy)benzamide Formula: C29H41N3O4 MolecularWeight: 495.65354

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC(=C1OCC2CCCCC2)C(=O)N)NC(=O)C(CC3=CCCC=C3)NC(=O)C

Isomeric SMILES

CCCC(C1=CC=CC(=C1OCC2CCCCC2)C(=O)N)NC(=O)[C@H](CC3=CCCC=C3)NC(=O)C

InChI

InChI=1S/C29H41N3O4/c1-3-11-25(32-29(35)26(31-20(2)33)18-21-12-6-4-7-13-21)23-16-10-17-24(28(30)34)27(23)36-19-22-14-8-5-9-15-22/h6,10,12-13,16-17,22,25-26H,3-5,7-9,11,14-15,18-19H2,1-2H3,(H2,30,34)(H,31,33)(H,32,35)/t25?,26-/m0/s1