1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]cyclopentane-1-carboxamide

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]cyclopentane-1-carboxamide Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]cyclopentanecarboxamide CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[[2-(1-imidazolylmethyl)phenyl]methyl]-1-cyclopentanecarboxamide IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]cyclopentane-1-carboxamide Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(imidazol-1-ylmethyl)benzyl]cyclopentanecarboxamide Formula: C25H27N3O3 MolecularWeight: 417.50018

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C2=CC3=C(C=C2)OCCO3)C(=O)NCC4=CC=CC=C4CN5C=CN=C5

Isomeric SMILES

C1CCC(C1)(C2=CC3=C(C=C2)OCCO3)C(=O)NCC4=CC=CC=C4CN5C=CN=C5

InChI

InChI=1S/C25H27N3O3/c29-24(27-16-19-5-1-2-6-20(19)17-28-12-11-26-18-28)25(9-3-4-10-25)21-7-8-22-23(15-21)31-14-13-30-22/h1-2,5-8,11-12,15,18H,3-4,9-10,13-14,16-17H2,(H,27,29)