methyl (3R)-4-[2-(2-aminophenyl)ethanoyl]-3-(pyrrolidin-1-ylmethyl)piperazine-1-carboxylate

Systemtic Name: methyl (3R)-4-[2-(2-aminophenyl)ethanoyl]-3-(pyrrolidin-1-ylmethyl)piperazine-1-carboxylate Openeye Name: methyl (3R)-4-[2-(2-aminophenyl)acetyl]-3-(pyrrolidin-1-ylmethyl)piperazine-1-carboxylate CAS Name: (3R)-4-[2-(2-aminophenyl)-1-oxoethyl]-3-(1-pyrrolidinylmethyl)-1-piperazinecarboxylic acid methyl ester IUPAC Name: methyl (3R)-4-[2-(2-aminophenyl)acetyl]-3-(pyrrolidin-1-ylmethyl)piperazine-1-carboxylate Traditional Name: (3R)-4-[2-(2-aminophenyl)acetyl]-3-(pyrrolidinomethyl)piperazine-1-carboxylic acid methyl ester Formula: C19H28N4O3 MolecularWeight: 360.45062

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCN(C(C1)CN2CCCC2)C(=O)CC3=CC=CC=C3N

Isomeric SMILES

COC(=O)N1CCN([C@@H](C1)CN2CCCC2)C(=O)CC3=CC=CC=C3N

InChI

InChI=1S/C19H28N4O3/c1-26-19(25)22-10-11-23(16(14-22)13-21-8-4-5-9-21)18(24)12-15-6-2-3-7-17(15)20/h2-3,6-7,16H,4-5,8-14,20H2,1H3/t16-/m1/s1