N-[4-[[4-(2-methylpropyl)morpholin-2-yl]methylcarbamoyl]phenyl]adamantane-1-carboxamide

Systemtic Name: N-[4-[[4-(2-methylpropyl)morpholin-2-yl]methylcarbamoyl]phenyl]adamantane-1-carboxamide Openeye Name: N-[4-[(4-isobutylmorpholin-2-yl)methylcarbamoyl]phenyl]adamantane-1-carboxamide CAS Name: N-[4-[[[4-(2-methylpropyl)-2-morpholinyl]methylamino]-oxomethyl]phenyl]-1-adamantanecarboxamide IUPAC Name: N-[4-[[4-(2-methylpropyl)morpholin-2-yl]methylcarbamoyl]phenyl]adamantane-1-carboxamide Traditional Name: N-[4-[(4-isobutylmorpholin-2-yl)methylcarbamoyl]phenyl]adamantane-1-carboxamide Formula: C27H39N3O3 MolecularWeight: 453.61686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CCOC(C1)CNC(=O)C2=CC=C(C=C2)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C)CN1CCOC(C1)CNC(=O)C2=CC=C(C=C2)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C27H39N3O3/c1-18(2)16-30-7-8-33-24(17-30)15-28-25(31)22-3-5-23(6-4-22)29-26(32)27-12-19-9-20(13-27)11-21(10-19)14-27/h3-6,18-21,24H,7-17H2,1-2H3,(H,28,31)(H,29,32)