3-(1-adamantyl)-N-[4-(2-hydroxyethylcarbamoyl)phenyl]-4-methoxy-benzamide

Systemtic Name: 3-(1-adamantyl)-N-[4-(2-hydroxyethylcarbamoyl)phenyl]-4-methoxy-benzamide Openeye Name: 3-(1-adamantyl)-N-[4-(2-hydroxyethylcarbamoyl)phenyl]-4-methoxy-benzamide CAS Name: 3-(1-adamantyl)-N-[4-[(2-hydroxyethylamino)-oxomethyl]phenyl]-4-methoxybenzamide IUPAC Name: 3-(1-adamantyl)-N-[4-(2-hydroxyethylcarbamoyl)phenyl]-4-methoxybenzamide Traditional Name: 3-(1-adamantyl)-N-[4-(2-hydroxyethylcarbamoyl)phenyl]-4-methoxy-benzamide Formula: C27H32N2O4 MolecularWeight: 448.55398

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)NCCO)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)NCCO)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C27H32N2O4/c1-33-24-7-4-21(13-23(24)27-14-17-10-18(15-27)12-19(11-17)16-27)26(32)29-22-5-2-20(3-6-22)25(31)28-8-9-30/h2-7,13,17-19,30H,8-12,14-16H2,1H3,(H,28,31)(H,29,32)