methyl 2-(1-adamantyl)-4-[6-(ethylcarbamoyl)naphthalen-2-yl]benzoate

Systemtic Name: methyl 2-(1-adamantyl)-4-[6-(ethylcarbamoyl)naphthalen-2-yl]benzoate Openeye Name: methyl 2-(1-adamantyl)-4-[6-(ethylcarbamoyl)-2-naphthyl]benzoate CAS Name: 2-(1-adamantyl)-4-[6-(ethylcarbamoyl)-2-naphthalenyl]benzoic acid methyl ester IUPAC Name: methyl 2-(1-adamantyl)-4-[6-(ethylcarbamoyl)naphthalen-2-yl]benzoate Traditional Name: 2-(1-adamantyl)-4-[6-(ethylcarbamoyl)-2-naphthyl]benzoic acid methyl ester Formula: C31H33NO3 MolecularWeight: 467.59862

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC2=C(C=C1)C=C(C=C2)C3=CC(=C(C=C3)C(=O)OC)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CCNC(=O)C1=CC2=C(C=C1)C=C(C=C2)C3=CC(=C(C=C3)C(=O)OC)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C31H33NO3/c1-3-32-29(33)26-7-6-22-13-23(4-5-24(22)14-26)25-8-9-27(30(34)35-2)28(15-25)31-16-19-10-20(17-31)12-21(11-19)18-31/h4-9,13-15,19-21H,3,10-12,16-18H2,1-2H3,(H,32,33)