N-(1,3-benzodioxol-5-yl)-1-[(2S)-2-(furan-2-ylcarbonylamino)-3-methyl-butanoyl]piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-[(2S)-2-(furan-2-ylcarbonylamino)-3-methyl-butanoyl]piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-[(2S)-2-(furan-2-carbonylamino)-3-methyl-butanoyl]piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[(2S)-2-[[2-furanyl(oxo)methyl]amino]-3-methyl-1-oxobutyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-[(2S)-2-(furan-2-carbonylamino)-3-methylbutanoyl]piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-[(2S)-2-(2-furoylamino)-3-methyl-butanoyl]isonipecotamide Formula: C23H27N3O6 MolecularWeight: 441.47698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCC(CC1)C(=O)NC2=CC3=C(C=C2)OCO3)NC(=O)C4=CC=CO4

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCC(CC1)C(=O)NC2=CC3=C(C=C2)OCO3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C23H27N3O6/c1-14(2)20(25-22(28)18-4-3-11-30-18)23(29)26-9-7-15(8-10-26)21(27)24-16-5-6-17-19(12-16)32-13-31-17/h3-6,11-12,14-15,20H,7-10,13H2,1-2H3,(H,24,27)(H,25,28)/t20-/m0/s1