[2-(1-adamantyl)-2-oxidanylidene-ethyl] 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylate

Systemtic Name: [2-(1-adamantyl)-2-oxidanylidene-ethyl] 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylate Openeye Name: [2-(1-adamantyl)-2-oxo-ethyl] 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylate CAS Name: 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylic acid [2-(1-adamantyl)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantyl)-2-oxoethyl] 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylate Traditional Name: 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylic acid [2-(1-adamantyl)-2-keto-ethyl] ester Formula: C26H30N2O3 MolecularWeight: 418.528

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)OCC(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CN1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)OCC(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C26H30N2O3/c1-28-7-6-22-20(14-28)24(19-4-2-3-5-21(19)27-22)25(30)31-15-23(29)26-11-16-8-17(12-26)10-18(9-16)13-26/h2-5,16-18H,6-15H2,1H3