4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-1-[(3-methylphenyl)methyl]-5-pentyl-pyrrole-3-carboxamide

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-1-[(3-methylphenyl)methyl]-5-pentyl-pyrrole-3-carboxamide Openeye Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-1-(m-tolylmethyl)-5-pentyl-pyrrole-3-carboxamide CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-1-[(3-methylphenyl)methyl]-5-pentyl-3-pyrrolecarboxamide IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-1-[(3-methylphenyl)methyl]-5-pentylpyrrole-3-carboxamide Traditional Name: 5-amyl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-1-(3-methylbenzyl)pyrrole-3-carboxamide Formula: C27H32N2O3 MolecularWeight: 432.55458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=C(N1CC2=CC=CC(=C2)C)C)C(=O)N)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CCCCCC1=C(C(=C(N1CC2=CC=CC(=C2)C)C)C(=O)N)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C27H32N2O3/c1-4-5-6-10-22-26(21-11-12-23-24(16-21)32-14-13-31-23)25(27(28)30)19(3)29(22)17-20-9-7-8-18(2)15-20/h7-9,11-12,15-16H,4-6,10,13-14,17H2,1-3H3,(H2,28,30)