2,2,5-trimethyl-N-(pyren-1-ylmethyl)-1,3-dioxan-5-amine

Systemtic Name: 2,2,5-trimethyl-N-(pyren-1-ylmethyl)-1,3-dioxan-5-amine Openeye Name: 2,2,5-trimethyl-N-(pyren-1-ylmethyl)-1,3-dioxan-5-amine CAS Name: 2,2,5-trimethyl-N-(1-pyrenylmethyl)-1,3-dioxan-5-amine IUPAC Name: 2,2,5-trimethyl-N-(pyren-1-ylmethyl)-1,3-dioxan-5-amine Traditional Name: pyren-1-ylmethyl-(2,2,5-trimethyl-1,3-dioxan-5-yl)amine Formula: C24H25NO2 MolecularWeight: 359.4608

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(CO1)(C)NCC2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C=C2)C

Isomeric SMILES

CC1(OCC(CO1)(C)NCC2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C=C2)C

InChI

InChI=1S/C24H25NO2/c1-23(2)26-14-24(3,15-27-23)25-13-19-10-9-18-8-7-16-5-4-6-17-11-12-20(19)22(18)21(16)17/h4-12,25H,13-15H2,1-3H3