tert-butyl 2-[azanyl(phenyl)amino]-3-(2-cyanopyrrolidin-1-yl)-3-oxidanylidene-propanoate

Systemtic Name: tert-butyl 2-[azanyl(phenyl)amino]-3-(2-cyanopyrrolidin-1-yl)-3-oxidanylidene-propanoate Openeye Name: tert-butyl 2-(N-aminoanilino)-3-(2-cyanopyrrolidin-1-yl)-3-oxo-propanoate CAS Name: 2-(N-aminoanilino)-3-(2-cyano-1-pyrrolidinyl)-3-oxopropanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-(N-aminoanilino)-3-(2-cyanopyrrolidin-1-yl)-3-oxopropanoate Traditional Name: 2-(N-aminoanilino)-3-(2-cyanopyrrolidino)-3-keto-propionic acid tert-butyl ester Formula: C18H24N4O3 MolecularWeight: 344.40816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C(=O)N1CCCC1C#N)N(C2=CC=CC=C2)N

Isomeric SMILES

CC(C)(C)OC(=O)C(C(=O)N1CCCC1C#N)N(C2=CC=CC=C2)N

InChI

InChI=1S/C18H24N4O3/c1-18(2,3)25-17(24)15(22(20)13-8-5-4-6-9-13)16(23)21-11-7-10-14(21)12-19/h4-6,8-9,14-15H,7,10-11,20H2,1-3H3