3-[(4-chlorophenyl)methyl-[2-(ethylamino)-2-oxidanylidene-ethyl]amino]pyrrolidine-1-carboxylic acid

Systemtic Name: 3-[(4-chlorophenyl)methyl-[2-(ethylamino)-2-oxidanylidene-ethyl]amino]pyrrolidine-1-carboxylic acid Openeye Name: 3-[(4-chlorophenyl)methyl-[2-(ethylamino)-2-oxo-ethyl]amino]pyrrolidine-1-carboxylic acid CAS Name: 3-[(4-chlorophenyl)methyl-[2-(ethylamino)-2-oxoethyl]amino]-1-pyrrolidinecarboxylic acid IUPAC Name: 3-[(4-chlorophenyl)methyl-[2-(ethylamino)-2-oxoethyl]amino]pyrrolidine-1-carboxylic acid Traditional Name: 3-[(4-chlorobenzyl)-[2-(ethylamino)-2-keto-ethyl]amino]pyrrolidine-1-carboxylic acid Formula: C16H22ClN3O3 MolecularWeight: 339.81718

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)CN(CC1=CC=C(C=C1)Cl)C2CCN(C2)C(=O)O

Isomeric SMILES

CCNC(=O)CN(CC1=CC=C(C=C1)Cl)C2CCN(C2)C(=O)O

InChI

InChI=1S/C16H22ClN3O3/c1-2-18-15(21)11-20(9-12-3-5-13(17)6-4-12)14-7-8-19(10-14)16(22)23/h3-6,14H,2,7-11H2,1H3,(H,18,21)(H,22,23)