ethyl (2S)-3-(dipentylamino)-3-oxidanylidene-2-(phenylmethyl)propanoate

Systemtic Name: ethyl (2S)-3-(dipentylamino)-3-oxidanylidene-2-(phenylmethyl)propanoate Openeye Name: ethyl (2S)-2-benzyl-3-(dipentylamino)-3-oxo-propanoate CAS Name: (2S)-3-(dipentylamino)-3-oxo-2-(phenylmethyl)propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-benzyl-3-(dipentylamino)-3-oxopropanoate Traditional Name: (2S)-2-benzyl-3-(diamylamino)-3-keto-propionic acid ethyl ester Formula: C22H35NO3 MolecularWeight: 361.5182

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCCC)C(=O)C(CC1=CC=CC=C1)C(=O)OCC

Isomeric SMILES

CCCCCN(CCCCC)C(=O)[C@H](CC1=CC=CC=C1)C(=O)OCC

InChI

InChI=1S/C22H35NO3/c1-4-7-12-16-23(17-13-8-5-2)21(24)20(22(25)26-6-3)18-19-14-10-9-11-15-19/h9-11,14-15,20H,4-8,12-13,16-18H2,1-3H3/t20-/m0/s1