4-[4-(2-azanyl-3,3-dimethyl-butanoyl)phenyl]piperazine-1-carboxylic acid

Systemtic Name: 4-[4-(2-azanyl-3,3-dimethyl-butanoyl)phenyl]piperazine-1-carboxylic acid Openeye Name: 4-[4-(2-amino-3,3-dimethyl-butanoyl)phenyl]piperazine-1-carboxylic acid CAS Name: 4-[4-(2-amino-3,3-dimethyl-1-oxobutyl)phenyl]-1-piperazinecarboxylic acid IUPAC Name: 4-[4-(2-amino-3,3-dimethylbutanoyl)phenyl]piperazine-1-carboxylic acid Traditional Name: 4-[4-(2-amino-3,3-dimethyl-butanoyl)phenyl]piperazine-1-carboxylic acid Formula: C17H25N3O3 MolecularWeight: 319.3987

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)O)N

Isomeric SMILES

CC(C)(C)C(C(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)O)N

InChI

InChI=1S/C17H25N3O3/c1-17(2,3)15(18)14(21)12-4-6-13(7-5-12)19-8-10-20(11-9-19)16(22)23/h4-7,15H,8-11,18H2,1-3H3,(H,22,23)