N-[6-[4-(2-methoxyethanoyl)piperazin-1-yl]pyridin-3-yl]adamantane-1-carboxamide

Systemtic Name: N-[6-[4-(2-methoxyethanoyl)piperazin-1-yl]pyridin-3-yl]adamantane-1-carboxamide Openeye Name: N-[6-[4-(2-methoxyacetyl)piperazin-1-yl]-3-pyridyl]adamantane-1-carboxamide CAS Name: N-[6-[4-(2-methoxy-1-oxoethyl)-1-piperazinyl]-3-pyridinyl]-1-adamantanecarboxamide IUPAC Name: N-[6-[4-(2-methoxyacetyl)piperazin-1-yl]pyridin-3-yl]adamantane-1-carboxamide Traditional Name: N-[6-[4-(2-methoxyacetyl)piperazino]-3-pyridyl]adamantane-1-carboxamide Formula: C23H32N4O3 MolecularWeight: 412.52518

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)N1CCN(CC1)C2=NC=C(C=C2)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COCC(=O)N1CCN(CC1)C2=NC=C(C=C2)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H32N4O3/c1-30-15-21(28)27-6-4-26(5-7-27)20-3-2-19(14-24-20)25-22(29)23-11-16-8-17(12-23)10-18(9-16)13-23/h2-3,14,16-18H,4-13,15H2,1H3,(H,25,29)