4-[[4-(2-azanylethyl)phenyl]methylcarbamoyl]piperazine-1-carboxylic acid

Systemtic Name: 4-[[4-(2-azanylethyl)phenyl]methylcarbamoyl]piperazine-1-carboxylic acid Openeye Name: 4-[[4-(2-aminoethyl)phenyl]methylcarbamoyl]piperazine-1-carboxylic acid CAS Name: 4-[[[4-(2-aminoethyl)phenyl]methylamino]-oxomethyl]-1-piperazinecarboxylic acid IUPAC Name: 4-[[4-(2-aminoethyl)phenyl]methylcarbamoyl]piperazine-1-carboxylic acid Traditional Name: 4-[[4-(2-aminoethyl)benzyl]carbamoyl]piperazine-1-carboxylic acid Formula: C15H22N4O3 MolecularWeight: 306.36018

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)NCC2=CC=C(C=C2)CCN)C(=O)O

Isomeric SMILES

C1CN(CCN1C(=O)NCC2=CC=C(C=C2)CCN)C(=O)O

InChI

InChI=1S/C15H22N4O3/c16-6-5-12-1-3-13(4-2-12)11-17-14(20)18-7-9-19(10-8-18)15(21)22/h1-4H,5-11,16H2,(H,17,20)(H,21,22)