[3-[[(2S)-2-ethylhexanoyl]-(phenylmethyl)amino]-2,2-dimethyl-3-oxidanylidene-propyl] ethanoate

Systemtic Name: [3-[[(2S)-2-ethylhexanoyl]-(phenylmethyl)amino]-2,2-dimethyl-3-oxidanylidene-propyl] ethanoate Openeye Name: [3-[benzyl-[(2S)-2-ethylhexanoyl]amino]-2,2-dimethyl-3-oxo-propyl] acetate CAS Name: acetic acid [3-[[(2S)-2-ethyl-1-oxohexyl]-(phenylmethyl)amino]-2,2-dimethyl-3-oxopropyl] ester IUPAC Name: [3-[benzyl-[(2S)-2-ethylhexanoyl]amino]-2,2-dimethyl-3-oxopropyl] acetate Traditional Name: acetic acid [3-[benzyl-[(2S)-2-ethylhexanoyl]amino]-3-keto-2,2-dimethyl-propyl] ester Formula: C22H33NO4 MolecularWeight: 375.50172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)N(CC1=CC=CC=C1)C(=O)C(C)(C)COC(=O)C

Isomeric SMILES

CCCC[C@H](CC)C(=O)N(CC1=CC=CC=C1)C(=O)C(C)(C)COC(=O)C

InChI

InChI=1S/C22H33NO4/c1-6-8-14-19(7-2)20(25)23(15-18-12-10-9-11-13-18)21(26)22(4,5)16-27-17(3)24/h9-13,19H,6-8,14-16H2,1-5H3/t19-/m0/s1