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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-[(2S)-2-[(4-methoxyphenyl)carbonylamino]-3-methyl-butanoyl]piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-[(2S)-2-[(4-methoxybenzoyl)amino]-3-methyl-butanoyl]piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[(2S)-2-[[(4-methoxyphenyl)-oxomethyl]amino]-3-methyl-1-oxobutyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-[(2S)-2-[(4-methoxybenzoyl)amino]-3-methylbutanoyl]piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-[(2S)-3-methyl-2-(p-anisoylamino)butanoyl]isonipecotamide Formula: C26H31N3O6 MolecularWeight: 481.54084

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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=C(C=C4)OC

Isomeric SMILES

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

InChI

InChI=1S/C26H31N3O6/c1-16(2)23(28-25(31)17-4-7-20(33-3)8-5-17)26(32)29-12-10-18(11-13-29)24(30)27-19-6-9-21-22(14-19)35-15-34-21/h4-9,14,16,18,23H,10-13,15H2,1-3H3,(H,27,30)(H,28,31)/t23-/m0/s1