N-cyclopropyl-N-[2-[(1-methylpyrrol-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-cyclopropyl-N-[2-[(1-methylpyrrol-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxo-ethyl]-N-cyclopropyl-1,3-benzodioxole-5-carboxamide CAS Name: N-cyclopropyl-N-[2-[(1-methyl-2-pyrrolyl)methyl-(phenylmethyl)amino]-2-oxoethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxoethyl]-N-cyclopropyl-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-keto-ethyl]-N-cyclopropyl-piperonylamide Formula: C26H27N3O4 MolecularWeight: 445.51028

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1CN(CC2=CC=CC=C2)C(=O)CN(C3CC3)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CN1C=CC=C1CN(CC2=CC=CC=C2)C(=O)CN(C3CC3)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C26H27N3O4/c1-27-13-5-8-22(27)16-28(15-19-6-3-2-4-7-19)25(30)17-29(21-10-11-21)26(31)20-9-12-23-24(14-20)33-18-32-23/h2-9,12-14,21H,10-11,15-18H2,1H3