2-methoxy-5-[3-[4-methoxy-3-(phenethylcarbamoyl)phenyl]-1-adamantyl]-N-phenethyl-benzamide

Systemtic Name: 2-methoxy-5-[3-[4-methoxy-3-(phenethylcarbamoyl)phenyl]-1-adamantyl]-N-phenethyl-benzamide Openeye Name: 2-methoxy-5-[3-[4-methoxy-3-(phenethylcarbamoyl)phenyl]-1-adamantyl]-N-phenethyl-benzamide CAS Name: 2-methoxy-5-[3-[4-methoxy-3-[oxo-(phenethylamino)methyl]phenyl]-1-adamantyl]-N-phenethylbenzamide IUPAC Name: 2-methoxy-5-[3-[4-methoxy-3-(phenethylcarbamoyl)phenyl]-1-adamantyl]-N-phenethylbenzamide Traditional Name: 2-methoxy-5-[3-[4-methoxy-3-(phenethylcarbamoyl)phenyl]-1-adamantyl]-N-phenethyl-benzamide Formula: C42H46N2O4 MolecularWeight: 642.82564

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C5=CC(=C(C=C5)OC)C(=O)NCCC6=CC=CC=C6)C(=O)NCCC7=CC=CC=C7

Isomeric SMILES

COC1=C(C=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C5=CC(=C(C=C5)OC)C(=O)NCCC6=CC=CC=C6)C(=O)NCCC7=CC=CC=C7

InChI

InChI=1S/C42H46N2O4/c1-47-37-15-13-33(22-35(37)39(45)43-19-17-29-9-5-3-6-10-29)41-24-31-21-32(25-41)27-42(26-31,28-41)34-14-16-38(48-2)36(23-34)40(46)44-20-18-30-11-7-4-8-12-30/h3-16,22-23,31-32H,17-21,24-28H2,1-2H3,(H,43,45)(H,44,46)