5-[3-azanyl-3-oxidanylidene-2-[(phenylmethyl)amino]propyl]pyrrolidine-1,2-dicarboxylic acid

Systemtic Name: 5-[3-azanyl-3-oxidanylidene-2-[(phenylmethyl)amino]propyl]pyrrolidine-1,2-dicarboxylic acid Openeye Name: 5-[3-amino-2-(benzylamino)-3-oxo-propyl]pyrrolidine-1,2-dicarboxylic acid CAS Name: 5-[3-amino-3-oxo-2-[(phenylmethyl)amino]propyl]pyrrolidine-1,2-dicarboxylic acid IUPAC Name: 5-[3-amino-2-(benzylamino)-3-oxopropyl]pyrrolidine-1,2-dicarboxylic acid Traditional Name: 5-[3-amino-2-(benzylamino)-3-keto-propyl]pyrrolidine-1,2-dicarboxylic acid Formula: C16H21N3O5 MolecularWeight: 335.35504

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1CC(C(=O)N)NCC2=CC=CC=C2)C(=O)O)C(=O)O

Isomeric SMILES

C1CC(N(C1CC(C(=O)N)NCC2=CC=CC=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C16H21N3O5/c17-14(20)12(18-9-10-4-2-1-3-5-10)8-11-6-7-13(15(21)22)19(11)16(23)24/h1-5,11-13,18H,6-9H2,(H2,17,20)(H,21,22)(H,23,24)