2-(1,3-benzodioxol-5-yl)-2-(3-cyano-2-methoxy-4-phenyl-pyrrol-1-yl)-N-cyclohexyl-ethanamide

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-2-(3-cyano-2-methoxy-4-phenyl-pyrrol-1-yl)-N-cyclohexyl-ethanamide Openeye Name: 2-(1,3-benzodioxol-5-yl)-2-(3-cyano-2-methoxy-4-phenyl-pyrrol-1-yl)-N-cyclohexyl-acetamide CAS Name: 2-(1,3-benzodioxol-5-yl)-2-(3-cyano-2-methoxy-4-phenyl-1-pyrrolyl)-N-cyclohexylacetamide IUPAC Name: 2-(1,3-benzodioxol-5-yl)-2-(3-cyano-2-methoxy-4-phenylpyrrol-1-yl)-N-cyclohexylacetamide Traditional Name: 2-(1,3-benzodioxol-5-yl)-2-(3-cyano-2-methoxy-4-phenyl-pyrrol-1-yl)-N-cyclohexyl-acetamide Formula: C27H27N3O4 MolecularWeight: 457.52098

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CN1C(C2=CC3=C(C=C2)OCO3)C(=O)NC4CCCCC4)C5=CC=CC=C5)C#N

Isomeric SMILES

COC1=C(C(=CN1C(C2=CC3=C(C=C2)OCO3)C(=O)NC4CCCCC4)C5=CC=CC=C5)C#N

InChI

InChI=1S/C27H27N3O4/c1-32-27-21(15-28)22(18-8-4-2-5-9-18)16-30(27)25(26(31)29-20-10-6-3-7-11-20)19-12-13-23-24(14-19)34-17-33-23/h2,4-5,8-9,12-14,16,20,25H,3,6-7,10-11,17H2,1H3,(H,29,31)