3-(1-adamantyl)-4-methoxy-1-(2-methylphenyl)naphthalene-2-carboxylic acid

Systemtic Name: 3-(1-adamantyl)-4-methoxy-1-(2-methylphenyl)naphthalene-2-carboxylic acid Openeye Name: 3-(1-adamantyl)-4-methoxy-1-(o-tolyl)naphthalene-2-carboxylic acid CAS Name: 3-(1-adamantyl)-4-methoxy-1-(2-methylphenyl)-2-naphthalenecarboxylic acid IUPAC Name: 3-(1-adamantyl)-4-methoxy-1-(2-methylphenyl)naphthalene-2-carboxylic acid Traditional Name: 3-(1-adamantyl)-4-methoxy-1-(o-tolyl)-2-naphthoic acid Formula: C29H30O3 MolecularWeight: 426.5467

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(C(=C(C3=CC=CC=C32)OC)C45CC6CC(C4)CC(C6)C5)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C2=C(C(=C(C3=CC=CC=C32)OC)C45CC6CC(C4)CC(C6)C5)C(=O)O

InChI

InChI=1S/C29H30O3/c1-17-7-3-4-8-21(17)24-22-9-5-6-10-23(22)27(32-2)26(25(24)28(30)31)29-14-18-11-19(15-29)13-20(12-18)16-29/h3-10,18-20H,11-16H2,1-2H3,(H,30,31)