N,N-dimethyl-4-[(pyren-1-ylmethylamino)methyl]naphthalen-1-amine dihydrochloride

Systemtic Name: N,N-dimethyl-4-[(pyren-1-ylmethylamino)methyl]naphthalen-1-amine dihydrochloride Openeye Name: N,N-dimethyl-4-[(pyren-1-ylmethylamino)methyl]naphthalen-1-amine dihydrochloride CAS Name: N,N-dimethyl-4-[(1-pyrenylmethylamino)methyl]-1-naphthalenamine dihydrochloride IUPAC Name: N,N-dimethyl-4-[(pyren-1-ylmethylamino)methyl]naphthalen-1-amine dihydrochloride Traditional Name: dimethyl-[4-[(pyren-1-ylmethylamino)methyl]-1-naphthyl]amine dihydrochloride Formula: C30H28Cl2N2 MolecularWeight: 487.46272

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C2=CC=CC=C21)CNCC3=C4C=CC5=CC=CC6=C5C4=C(C=C6)C=C3.Cl.Cl

Isomeric SMILES

CN(C)C1=CC=C(C2=CC=CC=C21)CNCC3=C4C=CC5=CC=CC6=C5C4=C(C=C6)C=C3.Cl.Cl

InChI

InChI=1S/C30H26N2.2ClH/c1-32(2)28-17-15-23(25-8-3-4-9-27(25)28)18-31-19-24-13-12-22-11-10-20-6-5-7-21-14-16-26(24)30(22)29(20)21;;/h3-17,31H,18-19H2,1-2H3;2*1H