3-(4-tert-butyl-2,6-dimethyl-phenyl)-1-[3-(4-tert-butyl-2,6-dimethyl-phenyl)-2-carboxy-naphthalen-1-yl]naphthalene-2-carboxylic acid

Systemtic Name: 3-(4-tert-butyl-2,6-dimethyl-phenyl)-1-[3-(4-tert-butyl-2,6-dimethyl-phenyl)-2-carboxy-naphthalen-1-yl]naphthalene-2-carboxylic acid Openeye Name: 3-(4-tert-butyl-2,6-dimethyl-phenyl)-1-[3-(4-tert-butyl-2,6-dimethyl-phenyl)-2-carboxy-1-naphthyl]naphthalene-2-carboxylic acid CAS Name: 3-(4-tert-butyl-2,6-dimethylphenyl)-1-[3-(4-tert-butyl-2,6-dimethylphenyl)-2-carboxy-1-naphthalenyl]-2-naphthalenecarboxylic acid IUPAC Name: 3-(4-tert-butyl-2,6-dimethylphenyl)-1-[3-(4-tert-butyl-2,6-dimethylphenyl)-2-carboxynaphthalen-1-yl]naphthalene-2-carboxylic acid Traditional Name: 3-(4-tert-butyl-2,6-dimethyl-phenyl)-1-[3-(4-tert-butyl-2,6-dimethyl-phenyl)-2-carboxy-1-naphthyl]-2-naphthoic acid Formula: C46H46O4 MolecularWeight: 662.85504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C2=CC3=CC=CC=C3C(=C2C(=O)O)C4=C(C(=CC5=CC=CC=C54)C6=C(C=C(C=C6C)C(C)(C)C)C)C(=O)O)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1C2=CC3=CC=CC=C3C(=C2C(=O)O)C4=C(C(=CC5=CC=CC=C54)C6=C(C=C(C=C6C)C(C)(C)C)C)C(=O)O)C)C(C)(C)C

InChI

InChI=1S/C46H46O4/c1-25-19-31(45(5,6)7)20-26(2)37(25)35-23-29-15-11-13-17-33(29)39(41(35)43(47)48)40-34-18-14-12-16-30(34)24-36(42(40)44(49)50)38-27(3)21-32(22-28(38)4)46(8,9)10/h11-24H,1-10H3,(H,47,48)(H,49,50)