ethyl 5-azanyl-4-[(2R)-2-[4-(2-cyanopropan-2-yl)phenyl]pyrrolidin-1-yl]carbonyl-pyridine-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-[(2R)-2-[4-(2-cyanopropan-2-yl)phenyl]pyrrolidin-1-yl]carbonyl-pyridine-2-carboxylate Openeye Name: ethyl 5-amino-4-[(2R)-2-[4-(1-cyano-1-methyl-ethyl)phenyl]pyrrolidine-1-carbonyl]pyridine-2-carboxylate CAS Name: 5-amino-4-[[(2R)-2-[4-(2-cyanopropan-2-yl)phenyl]-1-pyrrolidinyl]-oxomethyl]-2-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-[(2R)-2-[4-(2-cyanopropan-2-yl)phenyl]pyrrolidine-1-carbonyl]pyridine-2-carboxylate Traditional Name: 5-amino-4-[(2R)-2-[4-(1-cyano-1-methyl-ethyl)phenyl]pyrrolidine-1-carbonyl]picolinic acid ethyl ester Formula: C23H26N4O3 MolecularWeight: 406.47754

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC=C(C(=C1)C(=O)N2CCCC2C3=CC=C(C=C3)C(C)(C)C#N)N

Isomeric SMILES

CCOC(=O)C1=NC=C(C(=C1)C(=O)N2CCC[C@@H]2C3=CC=C(C=C3)C(C)(C)C#N)N

InChI

InChI=1S/C23H26N4O3/c1-4-30-22(29)19-12-17(18(25)13-26-19)21(28)27-11-5-6-20(27)15-7-9-16(10-8-15)23(2,3)14-24/h7-10,12-13,20H,4-6,11,25H2,1-3H3/t20-/m1/s1