[(2S)-1-(1-adamantylamino)-1-oxidanylidene-propan-2-yl] 2-naphthalen-2-ylethanoate

Systemtic Name: [(2S)-1-(1-adamantylamino)-1-oxidanylidene-propan-2-yl] 2-naphthalen-2-ylethanoate Openeye Name: [(1S)-2-(1-adamantylamino)-1-methyl-2-oxo-ethyl] 2-(2-naphthyl)acetate CAS Name: 2-(2-naphthalenyl)acetic acid [(2S)-1-(1-adamantylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(1-adamantylamino)-1-oxopropan-2-yl] 2-naphthalen-2-ylacetate Traditional Name: 2-(2-naphthyl)acetic acid [(1S)-2-(1-adamantylamino)-2-keto-1-methyl-ethyl] ester Formula: C25H29NO3 MolecularWeight: 391.50266

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC12CC3CC(C1)CC(C3)C2)OC(=O)CC4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C[C@@H](C(=O)NC12CC3CC(C1)CC(C3)C2)OC(=O)CC4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C25H29NO3/c1-16(24(28)26-25-13-18-8-19(14-25)10-20(9-18)15-25)29-23(27)12-17-6-7-21-4-2-3-5-22(21)11-17/h2-7,11,16,18-20H,8-10,12-15H2,1H3,(H,26,28)/t16-,18?,19?,20?,25?/m0/s1