methyl 1-[[3-(1,3-benzodioxol-5-ylmethyl)imidazol-4-yl]methyl]-2-methyl-4-naphthalen-1-yl-pyrrole-3-carboxylate

Systemtic Name: methyl 1-[[3-(1,3-benzodioxol-5-ylmethyl)imidazol-4-yl]methyl]-2-methyl-4-naphthalen-1-yl-pyrrole-3-carboxylate Openeye Name: methyl 1-[[3-(1,3-benzodioxol-5-ylmethyl)imidazol-4-yl]methyl]-2-methyl-4-(1-naphthyl)pyrrole-3-carboxylate CAS Name: 1-[[3-(1,3-benzodioxol-5-ylmethyl)-4-imidazolyl]methyl]-2-methyl-4-(1-naphthalenyl)-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-[[3-(1,3-benzodioxol-5-ylmethyl)imidazol-4-yl]methyl]-2-methyl-4-naphthalen-1-ylpyrrole-3-carboxylate Traditional Name: 2-methyl-4-(1-naphthyl)-1-[(3-piperonylimidazol-4-yl)methyl]pyrrole-3-carboxylic acid methyl ester Formula: C29H25N3O4 MolecularWeight: 479.5265

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CN1CC2=CN=CN2CC3=CC4=C(C=C3)OCO4)C5=CC=CC6=CC=CC=C65)C(=O)OC

Isomeric SMILES

CC1=C(C(=CN1CC2=CN=CN2CC3=CC4=C(C=C3)OCO4)C5=CC=CC6=CC=CC=C65)C(=O)OC

InChI

InChI=1S/C29H25N3O4/c1-19-28(29(33)34-2)25(24-9-5-7-21-6-3-4-8-23(21)24)16-31(19)15-22-13-30-17-32(22)14-20-10-11-26-27(12-20)36-18-35-26/h3-13,16-17H,14-15,18H2,1-2H3