1-chloranyl-6-[2-methyl-1-oxidanyl-1-[1-(triphenylmethyl)imidazol-4-yl]propyl]naphthalene-2-carboxylic acid

Systemtic Name: 1-chloranyl-6-[2-methyl-1-oxidanyl-1-[1-(triphenylmethyl)imidazol-4-yl]propyl]naphthalene-2-carboxylic acid Openeye Name: 1-chloro-6-[1-hydroxy-2-methyl-1-(1-tritylimidazol-4-yl)propyl]naphthalene-2-carboxylic acid CAS Name: 1-chloro-6-[1-hydroxy-2-methyl-1-[1-(triphenylmethyl)-4-imidazolyl]propyl]-2-naphthalenecarboxylic acid IUPAC Name: 1-chloro-6-[1-hydroxy-2-methyl-1-(1-tritylimidazol-4-yl)propyl]naphthalene-2-carboxylic acid Traditional Name: 1-chloro-6-[1-hydroxy-2-methyl-1-(1-tritylimidazol-4-yl)propyl]-2-naphthoic acid Formula: C37H31ClN2O3 MolecularWeight: 587.10664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC2=C(C=C1)C(=C(C=C2)C(=O)O)Cl)(C3=CN(C=N3)C(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)O

Isomeric SMILES

CC(C)C(C1=CC2=C(C=C1)C(=C(C=C2)C(=O)O)Cl)(C3=CN(C=N3)C(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)O

InChI

InChI=1S/C37H31ClN2O3/c1-25(2)37(43,30-19-21-31-26(22-30)18-20-32(34(31)38)35(41)42)33-23-40(24-39-33)36(27-12-6-3-7-13-27,28-14-8-4-9-15-28)29-16-10-5-11-17-29/h3-25,43H,1-2H3,(H,41,42)