ethyl (2S)-2-cyano-3-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]imino-propanoate

Systemtic Name: ethyl (2S)-2-cyano-3-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]imino-propanoate Openeye Name: ethyl (2S)-2-cyano-3-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]imino-propanoate CAS Name: (2S)-2-cyano-3-[(2S)-2-(4-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]iminopropanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-cyano-3-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ylethyl]iminopropanoate Traditional Name: (2S)-2-cyano-3-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidino-ethyl]imino-propionic acid ethyl ester Formula: C19H25N3O3 MolecularWeight: 343.4201

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C=NCC(C1=CC=C(C=C1)OC)N2CCCC2)C#N

Isomeric SMILES

CCOC(=O)[C@@H](C=NC[C@H](C1=CC=C(C=C1)OC)N2CCCC2)C#N

InChI

InChI=1S/C19H25N3O3/c1-3-25-19(23)16(12-20)13-21-14-18(22-10-4-5-11-22)15-6-8-17(24-2)9-7-15/h6-9,13,16,18H,3-5,10-11,14H2,1-2H3/t16-,18-/m1/s1