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2-(perylen-3-ylmethylamino)cyclohexane-1,3-diol

2-(perylen-3-ylmethylamino)cyclohexane-1,3-diol

Systemtic Name:2-(perylen-3-ylmethylamino)cyclohexane-1,3-diol
Openeye Name:2-(perylen-3-ylmethylamino)cyclohexane-1,3-diol
CAS Name:2-(3-perylenylmethylamino)cyclohexane-1,3-diol
IUPAC Name:2-(perylen-3-ylmethylamino)cyclohexane-1,3-diol
Traditional Name:2-(perylen-3-ylmethylamino)cyclohexane-1,3-diol
Formula: C27H25NO2
MolecularWeight: 395.4929
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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(C(C1)O)NCC2=CC=C3C4=CC=CC5=C4C(=CC=C5)C6=C3C2=CC=C6)O


Isomeric SMILES

C1CC(C(C(C1)O)NCC2=CC=C3C4=CC=CC5=C4C(=CC=C5)C6=C3C2=CC=C6)O


InChI

InChI=1S/C27H25NO2/c29-23-11-4-12-24(30)27(23)28-15-17-13-14-22-20-9-2-6-16-5-1-8-19(25(16)20)21-10-3-7-18(17)26(21)22/h1-3,5-10,13-14,23-24,27-30H,4,11-12,15H2


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