N-(1,3-benzodioxol-5-ylmethyl)-N'-[(2S)-octan-2-yl]butanediamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N'-[(2S)-octan-2-yl]butanediamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N'-[(1S)-1-methylheptyl]butanediamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N'-[(2S)-octan-2-yl]butanediamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N'-[(2S)-octan-2-yl]butanediamide Traditional Name: N'-[(1S)-1-methylheptyl]-N-piperonyl-succinamide Formula: C20H30N2O4 MolecularWeight: 362.4632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)NC(=O)CCC(=O)NCC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCCCCC[C@H](C)NC(=O)CCC(=O)NCC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C20H30N2O4/c1-3-4-5-6-7-15(2)22-20(24)11-10-19(23)21-13-16-8-9-17-18(12-16)26-14-25-17/h8-9,12,15H,3-7,10-11,13-14H2,1-2H3,(H,21,23)(H,22,24)/t15-/m0/s1