N-[(1S)-1-(1-adamantyl)ethyl]-3-(4-oxidanylidenecinnolin-1-yl)propanamide

Systemtic Name: N-[(1S)-1-(1-adamantyl)ethyl]-3-(4-oxidanylidenecinnolin-1-yl)propanamide Openeye Name: N-[(1S)-1-(1-adamantyl)ethyl]-3-(4-oxocinnolin-1-yl)propanamide CAS Name: N-[(1S)-1-(1-adamantyl)ethyl]-3-(4-oxo-1-cinnolinyl)propanamide IUPAC Name: N-[(1S)-1-(1-adamantyl)ethyl]-3-(4-oxocinnolin-1-yl)propanamide Traditional Name: N-[(1S)-1-(1-adamantyl)ethyl]-3-(4-ketocinnolin-1-yl)propionamide Formula: C23H29N3O2 MolecularWeight: 379.49526

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)CCN4C5=CC=CC=C5C(=O)C=N4

Isomeric SMILES

C[C@@H](C12CC3CC(C1)CC(C3)C2)NC(=O)CCN4C5=CC=CC=C5C(=O)C=N4

InChI

InChI=1S/C23H29N3O2/c1-15(23-11-16-8-17(12-23)10-18(9-16)13-23)25-22(28)6-7-26-20-5-3-2-4-19(20)21(27)14-24-26/h2-5,14-18H,6-13H2,1H3,(H,25,28)/t15-,16?,17?,18?,23?/m0/s1