3-(1,3-benzodioxol-5-yl)-3-phenyl-N-[(4-propan-2-yloxyphenyl)methyl]propan-1-amine hydrochloride

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-3-phenyl-N-[(4-propan-2-yloxyphenyl)methyl]propan-1-amine hydrochloride Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-[(4-isopropoxyphenyl)methyl]-3-phenyl-propan-1-amine hydrochloride CAS Name: 3-(1,3-benzodioxol-5-yl)-3-phenyl-N-[(4-propan-2-yloxyphenyl)methyl]-1-propanamine hydrochloride IUPAC Name: 3-(1,3-benzodioxol-5-yl)-3-phenyl-N-[(4-propan-2-yloxyphenyl)methyl]propan-1-amine hydrochloride Traditional Name: [3-(1,3-benzodioxol-5-yl)-3-phenyl-propyl]-(4-isopropoxybenzyl)amine hydrochloride Formula: C26H30ClNO3 MolecularWeight: 439.9743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)CNCCC(C2=CC=CC=C2)C3=CC4=C(C=C3)OCO4.Cl

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)CNCCC(C2=CC=CC=C2)C3=CC4=C(C=C3)OCO4.Cl

InChI

InChI=1S/C26H29NO3.ClH/c1-19(2)30-23-11-8-20(9-12-23)17-27-15-14-24(21-6-4-3-5-7-21)22-10-13-25-26(16-22)29-18-28-25;/h3-13,16,19,24,27H,14-15,17-18H2,1-2H3;1H