3-(1,3-benzodioxol-5-yl)-N-[(3,4-dimethoxyphenyl)methyl]-3-phenyl-propan-1-amine

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-[(3,4-dimethoxyphenyl)methyl]-3-phenyl-propan-1-amine Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-[(3,4-dimethoxyphenyl)methyl]-3-phenyl-propan-1-amine CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[(3,4-dimethoxyphenyl)methyl]-3-phenyl-1-propanamine IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-[(3,4-dimethoxyphenyl)methyl]-3-phenylpropan-1-amine Traditional Name: [3-(1,3-benzodioxol-5-yl)-3-phenyl-propyl]-veratryl-amine Formula: C25H27NO4 MolecularWeight: 405.48618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNCCC(C2=CC=CC=C2)C3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNCCC(C2=CC=CC=C2)C3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C25H27NO4/c1-27-22-10-8-18(14-24(22)28-2)16-26-13-12-21(19-6-4-3-5-7-19)20-9-11-23-25(15-20)30-17-29-23/h3-11,14-15,21,26H,12-13,16-17H2,1-2H3