N-(4-azanylcyclohexyl)-1-(1,3-benzodioxol-5-ylcarbonyl)-3-(4-methylphenyl)carbonyl-imidazolidine-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-1-(1,3-benzodioxol-5-ylcarbonyl)-3-(4-methylphenyl)carbonyl-imidazolidine-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-1-(1,3-benzodioxole-5-carbonyl)-3-(4-methylbenzoyl)imidazolidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-1-[1,3-benzodioxol-5-yl(oxo)methyl]-3-[(4-methylphenyl)-oxomethyl]-2-imidazolidinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-1-(1,3-benzodioxole-5-carbonyl)-3-(4-methylbenzoyl)imidazolidine-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-1-piperonyloyl-3-p-toluoyl-imidazolidine-2-carboxamide Formula: C26H30N4O5 MolecularWeight: 478.5402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(C2C(=O)NC3CCC(CC3)N)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(C2C(=O)NC3CCC(CC3)N)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C26H30N4O5/c1-16-2-4-17(5-3-16)25(32)29-12-13-30(24(29)23(31)28-20-9-7-19(27)8-10-20)26(33)18-6-11-21-22(14-18)35-15-34-21/h2-6,11,14,19-20,24H,7-10,12-13,15,27H2,1H3,(H,28,31)