2-[(12-chloranylchrysen-6-yl)methylamino]-2-methyl-propane-1,3-diol

Systemtic Name: 2-[(12-chloranylchrysen-6-yl)methylamino]-2-methyl-propane-1,3-diol Openeye Name: 2-[(12-chlorochrysen-6-yl)methylamino]-2-methyl-propane-1,3-diol CAS Name: 2-[(12-chloro-6-chrysenyl)methylamino]-2-methylpropane-1,3-diol IUPAC Name: 2-[(12-chlorochrysen-6-yl)methylamino]-2-methylpropane-1,3-diol Traditional Name: 2-[(12-chlorochrysen-6-yl)methylamino]-2-methyl-propane-1,3-diol Formula: C23H22ClNO2 MolecularWeight: 379.87928

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)(CO)NCC1=CC2=C(C=C(C3=CC=CC=C32)Cl)C4=CC=CC=C41

Isomeric SMILES

CC(CO)(CO)NCC1=CC2=C(C=C(C3=CC=CC=C32)Cl)C4=CC=CC=C41

InChI

InChI=1S/C23H22ClNO2/c1-23(13-26,14-27)25-12-15-10-20-18-8-4-5-9-19(18)22(24)11-21(20)17-7-3-2-6-16(15)17/h2-11,25-27H,12-14H2,1H3