3-(3-cyclohexa-1,3-dien-1-ylpropyl)-5-phenylmethoxy-1H-indole; 1,4-dioxin-2-ylmethanamine

Systemtic Name: 3-(3-cyclohexa-1,3-dien-1-ylpropyl)-5-phenylmethoxy-1H-indole; 1,4-dioxin-2-ylmethanamine Openeye Name: 5-benzyloxy-3-(3-cyclohexa-1,3-dien-1-ylpropyl)-1H-indole; 1,4-dioxin-2-ylmethanamine CAS Name: 3-[3-(1-cyclohexa-1,3-dienyl)propyl]-5-phenylmethoxy-1H-indole; 1,4-dioxin-2-ylmethanamine IUPAC Name: 3-(3-cyclohexa-1,3-dien-1-ylpropyl)-5-phenylmethoxy-1H-indole; 1,4-dioxin-2-ylmethanamine Traditional Name: 5-benzoxy-3-(3-cyclohexa-1,3-dien-1-ylpropyl)-1H-indole; p-dioxin-2-ylmethylamine Formula: C29H32N2O3 MolecularWeight: 456.57598

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC=C1)CCCC2=CNC3=C2C=C(C=C3)OCC4=CC=CC=C4.C1=COC(=CO1)CN

Isomeric SMILES

C1CC(=CC=C1)CCCC2=CNC3=C2C=C(C=C3)OCC4=CC=CC=C4.C1=COC(=CO1)CN

InChI

InChI=1S/C24H25NO.C5H7NO2/c1-3-8-19(9-4-1)12-7-13-21-17-25-24-15-14-22(16-23(21)24)26-18-20-10-5-2-6-11-20;6-3-5-4-7-1-2-8-5/h1-3,5-6,8,10-11,14-17,25H,4,7,9,12-13,18H2;1-2,4H,3,6H2