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

Systemtic Name: N-[(3S)-1-(4-benzamidopiperidin-1-yl)carbonylpiperidin-3-yl]-4-oxidanyl-adamantane-1-carboxamide Openeye Name: N-[(3S)-1-(4-benzamidopiperidine-1-carbonyl)-3-piperidyl]-4-hydroxy-adamantane-1-carboxamide CAS Name: N-[(3S)-1-[(4-benzamido-1-piperidinyl)-oxomethyl]-3-piperidinyl]-4-hydroxy-1-adamantanecarboxamide IUPAC Name: N-[(3S)-1-(4-benzamidopiperidine-1-carbonyl)piperidin-3-yl]-4-hydroxyadamantane-1-carboxamide Traditional Name: N-[(3S)-1-(4-benzamidopiperidine-1-carbonyl)-3-piperidyl]-4-hydroxy-adamantane-1-carboxamide Formula: C29H40N4O4 MolecularWeight: 508.6523

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)N2CCC(CC2)NC(=O)C3=CC=CC=C3)NC(=O)C45CC6CC(C4)C(C(C6)C5)O

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)N2CCC(CC2)NC(=O)C3=CC=CC=C3)NC(=O)C45CC6CC(C4)C(C(C6)C5)O

InChI

InChI=1S/C29H40N4O4/c34-25-21-13-19-14-22(25)17-29(15-19,16-21)27(36)31-24-7-4-10-33(18-24)28(37)32-11-8-23(9-12-32)30-26(35)20-5-2-1-3-6-20/h1-3,5-6,19,21-25,34H,4,7-18H2,(H,30,35)(H,31,36)/t19?,21?,22?,24-,25?,29?/m0/s1