N-[1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-phenyl-propan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-phenyl-propan-2-yl]adamantane-1-carboxamide Openeye Name: N-[1-benzyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]adamantane-1-carboxamide CAS Name: N-[1-[4-(2-methoxyphenyl)-1-piperazinyl]-3-phenylpropan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-phenylpropan-2-yl]adamantane-1-carboxamide Traditional Name: N-[1-benzyl-2-[4-(2-methoxyphenyl)piperazino]ethyl]adamantane-1-carboxamide Formula: C31H41N3O2 MolecularWeight: 487.67614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CC(CC3=CC=CC=C3)NC(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CC(CC3=CC=CC=C3)NC(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C31H41N3O2/c1-36-29-10-6-5-9-28(29)34-13-11-33(12-14-34)22-27(18-23-7-3-2-4-8-23)32-30(35)31-19-24-15-25(20-31)17-26(16-24)21-31/h2-10,24-27H,11-22H2,1H3,(H,32,35)