4-[2-(aminomethyl)-3-[(2-chlorophenyl)methylamino]phenyl]piperazine-1-carboxylic acid

Systemtic Name: 4-[2-(aminomethyl)-3-[(2-chlorophenyl)methylamino]phenyl]piperazine-1-carboxylic acid Openeye Name: 4-[2-(aminomethyl)-3-[(2-chlorophenyl)methylamino]phenyl]piperazine-1-carboxylic acid CAS Name: 4-[2-(aminomethyl)-3-[(2-chlorophenyl)methylamino]phenyl]-1-piperazinecarboxylic acid IUPAC Name: 4-[2-(aminomethyl)-3-[(2-chlorophenyl)methylamino]phenyl]piperazine-1-carboxylic acid Traditional Name: 4-[2-(aminomethyl)-3-[(2-chlorobenzyl)amino]phenyl]piperazine-1-carboxylic acid Formula: C19H23ClN4O2 MolecularWeight: 374.86452

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=CC=C2)NCC3=CC=CC=C3Cl)CN)C(=O)O

Isomeric SMILES

C1CN(CCN1C2=C(C(=CC=C2)NCC3=CC=CC=C3Cl)CN)C(=O)O

InChI

InChI=1S/C19H23ClN4O2/c20-16-5-2-1-4-14(16)13-22-17-6-3-7-18(15(17)12-21)23-8-10-24(11-9-23)19(25)26/h1-7,22H,8-13,21H2,(H,25,26)