4-[3,4-bis(azanyl)phenyl]-3-methyl-piperazine-1-carboxylic acid

Systemtic Name: 4-[3,4-bis(azanyl)phenyl]-3-methyl-piperazine-1-carboxylic acid Openeye Name: 4-(3,4-diaminophenyl)-3-methyl-piperazine-1-carboxylic acid CAS Name: 4-(3,4-diaminophenyl)-3-methyl-1-piperazinecarboxylic acid IUPAC Name: 4-(3,4-diaminophenyl)-3-methylpiperazine-1-carboxylic acid Traditional Name: 4-(3,4-diaminophenyl)-3-methyl-piperazine-1-carboxylic acid Formula: C12H18N4O2 MolecularWeight: 250.29692

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC(=C(C=C2)N)N)C(=O)O

Isomeric SMILES

CC1CN(CCN1C2=CC(=C(C=C2)N)N)C(=O)O

InChI

InChI=1S/C12H18N4O2/c1-8-7-15(12(17)18)4-5-16(8)9-2-3-10(13)11(14)6-9/h2-3,6,8H,4-5,7,13-14H2,1H3,(H,17,18)