3-[[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-indol-3-yl]methyl]-1-imidazol-1-yl-pentan-1-one

Systemtic Name: 3-[[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-indol-3-yl]methyl]-1-imidazol-1-yl-pentan-1-one Openeye Name: 3-[[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-indol-3-yl]methyl]-1-imidazol-1-yl-pentan-1-one CAS Name: 3-[[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-3-indolyl]methyl]-1-(1-imidazolyl)-1-pentanone IUPAC Name: 3-[[1-[(4-bromophenyl)methyl]-5-methoxy-2-methylindol-3-yl]methyl]-1-imidazol-1-ylpentan-1-one Traditional Name: 3-[[1-(4-bromobenzyl)-5-methoxy-2-methyl-indol-3-yl]methyl]-1-imidazol-1-yl-pentan-1-one Formula: C26H28BrN3O2 MolecularWeight: 494.42342

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=C(N(C2=C1C=C(C=C2)OC)CC3=CC=C(C=C3)Br)C)CC(=O)N4C=CN=C4

Isomeric SMILES

CCC(CC1=C(N(C2=C1C=C(C=C2)OC)CC3=CC=C(C=C3)Br)C)CC(=O)N4C=CN=C4

InChI

InChI=1S/C26H28BrN3O2/c1-4-19(14-26(31)29-12-11-28-17-29)13-23-18(2)30(16-20-5-7-21(27)8-6-20)25-10-9-22(32-3)15-24(23)25/h5-12,15,17,19H,4,13-14,16H2,1-3H3