(3S)-N3-(1,3-benzodioxol-5-ylmethyl)-N1-cyclohexyl-piperidine-1,3-dicarboxamide

Systemtic Name: (3S)-N3-(1,3-benzodioxol-5-ylmethyl)-N1-cyclohexyl-piperidine-1,3-dicarboxamide Openeye Name: (3S)-N3-(1,3-benzodioxol-5-ylmethyl)-N1-cyclohexyl-piperidine-1,3-dicarboxamide CAS Name: (3S)-N3-(1,3-benzodioxol-5-ylmethyl)-N1-cyclohexylpiperidine-1,3-dicarboxamide IUPAC Name: (3S)-3-N-(1,3-benzodioxol-5-ylmethyl)-1-N-cyclohexylpiperidine-1,3-dicarboxamide Traditional Name: (3S)-N-cyclohexyl-N'-piperonyl-piperidine-1,3-dicarboxamide Formula: C21H29N3O4 MolecularWeight: 387.47266

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)N2CCCC(C2)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCC(CC1)NC(=O)N2CCC[C@@H](C2)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H29N3O4/c25-20(22-12-15-8-9-18-19(11-15)28-14-27-18)16-5-4-10-24(13-16)21(26)23-17-6-2-1-3-7-17/h8-9,11,16-17H,1-7,10,12-14H2,(H,22,25)(H,23,26)/t16-/m0/s1