N-[(2R)-1-(1,3-benzodioxol-5-ylamino)-3-methyl-1-oxidanylidene-butan-2-yl]-4-methyl-cyclohexane-1-carboxamide

Systemtic Name: N-[(2R)-1-(1,3-benzodioxol-5-ylamino)-3-methyl-1-oxidanylidene-butan-2-yl]-4-methyl-cyclohexane-1-carboxamide Openeye Name: N-[(1R)-1-(1,3-benzodioxol-5-ylcarbamoyl)-2-methyl-propyl]-4-methyl-cyclohexanecarboxamide CAS Name: N-[(2R)-1-(1,3-benzodioxol-5-ylamino)-3-methyl-1-oxobutan-2-yl]-4-methyl-1-cyclohexanecarboxamide IUPAC Name: N-[(2R)-1-(1,3-benzodioxol-5-ylamino)-3-methyl-1-oxobutan-2-yl]-4-methylcyclohexane-1-carboxamide Traditional Name: N-[(1R)-1-(1,3-benzodioxol-5-ylcarbamoyl)-2-methyl-propyl]-4-methyl-cyclohexanecarboxamide Formula: C20H28N2O4 MolecularWeight: 360.44732

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C(=O)NC(C(C)C)C(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1CCC(CC1)C(=O)N[C@H](C(C)C)C(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H28N2O4/c1-12(2)18(22-19(23)14-6-4-13(3)5-7-14)20(24)21-15-8-9-16-17(10-15)26-11-25-16/h8-10,12-14,18H,4-7,11H2,1-3H3,(H,21,24)(H,22,23)/t13?,14?,18-/m1/s1