N-[(1R)-1-(1-adamantyl)ethyl]-2-(4-ethoxyphenyl)quinoline-4-carboxamide

Systemtic Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-(4-ethoxyphenyl)quinoline-4-carboxamide Openeye Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-(4-ethoxyphenyl)quinoline-4-carboxamide CAS Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-(4-ethoxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-(4-ethoxyphenyl)quinoline-4-carboxamide Traditional Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-p-phenetyl-cinchoninamide Formula: C30H34N2O2 MolecularWeight: 454.60316

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC(C)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N[C@H](C)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C30H34N2O2/c1-3-34-24-10-8-23(9-11-24)28-15-26(25-6-4-5-7-27(25)32-28)29(33)31-19(2)30-16-20-12-21(17-30)14-22(13-20)18-30/h4-11,15,19-22H,3,12-14,16-18H2,1-2H3,(H,31,33)/t19-,20?,21?,22?,30?/m1/s1