4-oxidanyl-N-[(3S)-1-(4-phenylpiperazin-1-yl)carbonylpiperidin-3-yl]adamantane-1-carboxamide

Systemtic Name: 4-oxidanyl-N-[(3S)-1-(4-phenylpiperazin-1-yl)carbonylpiperidin-3-yl]adamantane-1-carboxamide Openeye Name: 4-hydroxy-N-[(3S)-1-(4-phenylpiperazine-1-carbonyl)-3-piperidyl]adamantane-1-carboxamide CAS Name: 4-hydroxy-N-[(3S)-1-[oxo-(4-phenyl-1-piperazinyl)methyl]-3-piperidinyl]-1-adamantanecarboxamide IUPAC Name: 4-hydroxy-N-[(3S)-1-(4-phenylpiperazine-1-carbonyl)piperidin-3-yl]adamantane-1-carboxamide Traditional Name: 4-hydroxy-N-[(3S)-1-(4-phenylpiperazine-1-carbonyl)-3-piperidyl]adamantane-1-carboxamide Formula: C27H38N4O3 MolecularWeight: 466.61562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)N2CCN(CC2)C3=CC=CC=C3)NC(=O)C45CC6CC(C4)C(C(C6)C5)O

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)N2CCN(CC2)C3=CC=CC=C3)NC(=O)C45CC6CC(C4)C(C(C6)C5)O

InChI

InChI=1S/C27H38N4O3/c32-24-20-13-19-14-21(24)17-27(15-19,16-20)25(33)28-22-5-4-8-31(18-22)26(34)30-11-9-29(10-12-30)23-6-2-1-3-7-23/h1-3,6-7,19-22,24,32H,4-5,8-18H2,(H,28,33)/t19?,20?,21?,22-,24?,27?/m0/s1