N-[3-[[2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]amino]-3-oxidanylidene-propyl]adamantane-1-carboxamide

Systemtic Name: N-[3-[[2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]amino]-3-oxidanylidene-propyl]adamantane-1-carboxamide Openeye Name: N-[3-[[2-(4-methoxyphenyl)-2-(1-piperidyl)ethyl]amino]-3-oxo-propyl]adamantane-1-carboxamide CAS Name: N-[3-[[2-(4-methoxyphenyl)-2-(1-piperidinyl)ethyl]amino]-3-oxopropyl]-1-adamantanecarboxamide IUPAC Name: N-[3-[[2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]amino]-3-oxopropyl]adamantane-1-carboxamide Traditional Name: N-[3-keto-3-[[2-(4-methoxyphenyl)-2-piperidino-ethyl]amino]propyl]adamantane-1-carboxamide Formula: C28H41N3O3 MolecularWeight: 467.64344

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)CCNC(=O)C23CC4CC(C2)CC(C4)C3)N5CCCCC5

Isomeric SMILES

COC1=CC=C(C=C1)C(CNC(=O)CCNC(=O)C23CC4CC(C2)CC(C4)C3)N5CCCCC5

InChI

InChI=1S/C28H41N3O3/c1-34-24-7-5-23(6-8-24)25(31-11-3-2-4-12-31)19-30-26(32)9-10-29-27(33)28-16-20-13-21(17-28)15-22(14-20)18-28/h5-8,20-22,25H,2-4,9-19H2,1H3,(H,29,33)(H,30,32)