4-(3-butoxycarbonylphenyl)piperazine-1-carboxylic acid

Systemtic Name: 4-(3-butoxycarbonylphenyl)piperazine-1-carboxylic acid Openeye Name: 4-(3-butoxycarbonylphenyl)piperazine-1-carboxylic acid CAS Name: 4-[3-[butoxy(oxo)methyl]phenyl]-1-piperazinecarboxylic acid IUPAC Name: 4-(3-butoxycarbonylphenyl)piperazine-1-carboxylic acid Traditional Name: 4-(3-butoxycarbonylphenyl)piperazine-1-carboxylic acid Formula: C16H22N2O4 MolecularWeight: 306.35688

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O4/c1-2-3-11-22-15(19)13-5-4-6-14(12-13)17-7-9-18(10-8-17)16(20)21/h4-6,12H,2-3,7-11H2,1H3,(H,20,21)