1-(1,3-benzodioxol-5-yl)-N-[(4-hexoxy-3-methoxy-phenyl)methyl]methanamine

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-N-[(4-hexoxy-3-methoxy-phenyl)methyl]methanamine Openeye Name: 1-(1,3-benzodioxol-5-yl)-N-[(4-hexoxy-3-methoxy-phenyl)methyl]methanamine CAS Name: 1-(1,3-benzodioxol-5-yl)-N-[(4-hexoxy-3-methoxyphenyl)methyl]methanamine IUPAC Name: 1-(1,3-benzodioxol-5-yl)-N-[(4-hexoxy-3-methoxyphenyl)methyl]methanamine Traditional Name: (4-hexoxy-3-methoxy-benzyl)-piperonyl-amine Formula: C22H29NO4 MolecularWeight: 371.46996

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)CNCC2=CC3=C(C=C2)OCO3)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)CNCC2=CC3=C(C=C2)OCO3)OC

InChI

InChI=1S/C22H29NO4/c1-3-4-5-6-11-25-19-9-7-17(12-21(19)24-2)14-23-15-18-8-10-20-22(13-18)27-16-26-20/h7-10,12-13,23H,3-6,11,14-16H2,1-2H3