N-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-N-(phenylmethyl)-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-N-(phenylmethyl)-1,3-benzodioxole-5-carboxamide Openeye Name: N-benzyl-N-[[1-(o-tolylmethyl)pyrrol-2-yl]methyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[[1-[(2-methylphenyl)methyl]-2-pyrrolyl]methyl]-N-(phenylmethyl)-1,3-benzodioxole-5-carboxamide IUPAC Name: N-benzyl-N-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-benzyl-N-[[1-(2-methylbenzyl)pyrrol-2-yl]methyl]-piperonylamide Formula: C28H26N2O3 MolecularWeight: 438.51764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=CC=C2CN(CC3=CC=CC=C3)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC=CC=C1CN2C=CC=C2CN(CC3=CC=CC=C3)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C28H26N2O3/c1-21-8-5-6-11-24(21)18-29-15-7-12-25(29)19-30(17-22-9-3-2-4-10-22)28(31)23-13-14-26-27(16-23)33-20-32-26/h2-16H,17-20H2,1H3