3-(1-adamantyl)-4-methoxy-N-[1-(phenylcarbonyl)pyrrolidin-2-yl]benzamide

Systemtic Name: 3-(1-adamantyl)-4-methoxy-N-[1-(phenylcarbonyl)pyrrolidin-2-yl]benzamide Openeye Name: 3-(1-adamantyl)-N-(1-benzoylpyrrolidin-2-yl)-4-methoxy-benzamide CAS Name: 3-(1-adamantyl)-N-(1-benzoyl-2-pyrrolidinyl)-4-methoxybenzamide IUPAC Name: 3-(1-adamantyl)-N-(1-benzoylpyrrolidin-2-yl)-4-methoxybenzamide Traditional Name: 3-(1-adamantyl)-N-(1-benzoylpyrrolidin-2-yl)-4-methoxy-benzamide Formula: C29H34N2O3 MolecularWeight: 458.59186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2CCCN2C(=O)C3=CC=CC=C3)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2CCCN2C(=O)C3=CC=CC=C3)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C29H34N2O3/c1-34-25-10-9-23(15-24(25)29-16-19-12-20(17-29)14-21(13-19)18-29)27(32)30-26-8-5-11-31(26)28(33)22-6-3-2-4-7-22/h2-4,6-7,9-10,15,19-21,26H,5,8,11-14,16-18H2,1H3,(H,30,32)