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

Systemtic Name: N-cyclohexyl-N-[2-[2-methylpropyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-cyclohexyl-N-[2-[isobutyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxo-ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-cyclohexyl-N-[2-[2-methylpropyl-[(1-methyl-2-pyrrolyl)methyl]amino]-2-oxoethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-cyclohexyl-N-[2-[2-methylpropyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxoethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-cyclohexyl-N-[2-[isobutyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-keto-ethyl]-piperonylamide Formula: C26H35N3O4 MolecularWeight: 453.5738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1=CC=CN1C)C(=O)CN(C2CCCCC2)C(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)CN(CC1=CC=CN1C)C(=O)CN(C2CCCCC2)C(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C26H35N3O4/c1-19(2)15-28(16-22-10-7-13-27(22)3)25(30)17-29(21-8-5-4-6-9-21)26(31)20-11-12-23-24(14-20)33-18-32-23/h7,10-14,19,21H,4-6,8-9,15-18H2,1-3H3