[2-[(4-propoxyphenyl)carbamoyl]phenyl] adamantane-1-carboxylate

Systemtic Name: [2-[(4-propoxyphenyl)carbamoyl]phenyl] adamantane-1-carboxylate Openeye Name: [2-[(4-propoxyphenyl)carbamoyl]phenyl] adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid [2-[oxo-(4-propoxyanilino)methyl]phenyl] ester IUPAC Name: [2-[(4-propoxyphenyl)carbamoyl]phenyl] adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid [2-[(4-propoxyphenyl)carbamoyl]phenyl] ester Formula: C27H31NO4 MolecularWeight: 433.53934

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2OC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCCOC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2OC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C27H31NO4/c1-2-11-31-22-9-7-21(8-10-22)28-25(29)23-5-3-4-6-24(23)32-26(30)27-15-18-12-19(16-27)14-20(13-18)17-27/h3-10,18-20H,2,11-17H2,1H3,(H,28,29)