1-(1,3-benzodioxol-5-yl)-N-[(3-ethoxy-2-phenylmethoxy-phenyl)methyl]methanamine

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-N-[(3-ethoxy-2-phenylmethoxy-phenyl)methyl]methanamine Openeye Name: 1-(1,3-benzodioxol-5-yl)-N-[(2-benzyloxy-3-ethoxy-phenyl)methyl]methanamine CAS Name: 1-(1,3-benzodioxol-5-yl)-N-[(3-ethoxy-2-phenylmethoxyphenyl)methyl]methanamine IUPAC Name: 1-(1,3-benzodioxol-5-yl)-N-[(3-ethoxy-2-phenylmethoxyphenyl)methyl]methanamine Traditional Name: (2-benzoxy-3-ethoxy-benzyl)-piperonyl-amine Formula: C24H25NO4 MolecularWeight: 391.4596

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1OCC2=CC=CC=C2)CNCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC1=CC=CC(=C1OCC2=CC=CC=C2)CNCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H25NO4/c1-2-26-22-10-6-9-20(24(22)27-16-18-7-4-3-5-8-18)15-25-14-19-11-12-21-23(13-19)29-17-28-21/h3-13,25H,2,14-17H2,1H3