[2-(1-adamantylamino)-2-oxidanylidene-ethyl] 2-naphthalen-1-ylquinoline-4-carboxylate

Systemtic Name: [2-(1-adamantylamino)-2-oxidanylidene-ethyl] 2-naphthalen-1-ylquinoline-4-carboxylate Openeye Name: [2-(1-adamantylamino)-2-oxo-ethyl] 2-(1-naphthyl)quinoline-4-carboxylate CAS Name: 2-(1-naphthalenyl)-4-quinolinecarboxylic acid [2-(1-adamantylamino)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantylamino)-2-oxoethyl] 2-naphthalen-1-ylquinoline-4-carboxylate Traditional Name: 2-(1-naphthyl)cinchoninic acid [2-(1-adamantylamino)-2-keto-ethyl] ester Formula: C32H30N2O3 MolecularWeight: 490.5922

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)COC(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=CC7=CC=CC=C76

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)COC(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=CC7=CC=CC=C76

InChI

InChI=1S/C32H30N2O3/c35-30(34-32-16-20-12-21(17-32)14-22(13-20)18-32)19-37-31(36)27-15-29(33-28-11-4-3-9-26(27)28)25-10-5-7-23-6-1-2-8-24(23)25/h1-11,15,20-22H,12-14,16-19H2,(H,34,35)