[4-(dimethylcarbamoyl)phenyl] 3-(1-adamantyl)-4-methoxy-benzoate

Systemtic Name: [4-(dimethylcarbamoyl)phenyl] 3-(1-adamantyl)-4-methoxy-benzoate Openeye Name: [4-(dimethylcarbamoyl)phenyl] 3-(1-adamantyl)-4-methoxy-benzoate CAS Name: 3-(1-adamantyl)-4-methoxybenzoic acid [4-[dimethylamino(oxo)methyl]phenyl] ester IUPAC Name: [4-(dimethylcarbamoyl)phenyl] 3-(1-adamantyl)-4-methoxybenzoate Traditional Name: 3-(1-adamantyl)-4-methoxy-benzoic acid [4-(dimethylcarbamoyl)phenyl] ester Formula: C27H31NO4 MolecularWeight: 433.53934

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)OC)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CN(C)C(=O)C1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)OC)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C27H31NO4/c1-28(2)25(29)20-4-7-22(8-5-20)32-26(30)21-6-9-24(31-3)23(13-21)27-14-17-10-18(15-27)12-19(11-17)16-27/h4-9,13,17-19H,10-12,14-16H2,1-3H3