1-[(3-chlorophenyl)methyl]-2-methyl-5-pentyl-4-(3-phenoxyphenyl)pyrrole-3-carboxamide

Systemtic Name: 1-[(3-chlorophenyl)methyl]-2-methyl-5-pentyl-4-(3-phenoxyphenyl)pyrrole-3-carboxamide Openeye Name: 1-[(3-chlorophenyl)methyl]-2-methyl-5-pentyl-4-(3-phenoxyphenyl)pyrrole-3-carboxamide CAS Name: 1-[(3-chlorophenyl)methyl]-2-methyl-5-pentyl-4-(3-phenoxyphenyl)-3-pyrrolecarboxamide IUPAC Name: 1-[(3-chlorophenyl)methyl]-2-methyl-5-pentyl-4-(3-phenoxyphenyl)pyrrole-3-carboxamide Traditional Name: 5-amyl-1-(3-chlorobenzyl)-2-methyl-4-(3-phenoxyphenyl)pyrrole-3-carboxamide Formula: C30H31ClN2O2 MolecularWeight: 487.03234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=C(N1CC2=CC(=CC=C2)Cl)C)C(=O)N)C3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

CCCCCC1=C(C(=C(N1CC2=CC(=CC=C2)Cl)C)C(=O)N)C3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C30H31ClN2O2/c1-3-4-6-17-27-29(23-12-10-16-26(19-23)35-25-14-7-5-8-15-25)28(30(32)34)21(2)33(27)20-22-11-9-13-24(31)18-22/h5,7-16,18-19H,3-4,6,17,20H2,1-2H3,(H2,32,34)