2-[[3-(4-phenylpiperazin-1-yl)propylcarbamoylamino]methyl]butanoic acid

Systemtic Name: 2-[[3-(4-phenylpiperazin-1-yl)propylcarbamoylamino]methyl]butanoic acid Openeye Name: 2-[[3-(4-phenylpiperazin-1-yl)propylcarbamoylamino]methyl]butanoic acid CAS Name: 2-[[[oxo-[3-(4-phenyl-1-piperazinyl)propylamino]methyl]amino]methyl]butanoic acid IUPAC Name: 2-[[3-(4-phenylpiperazin-1-yl)propylcarbamoylamino]methyl]butanoic acid Traditional Name: 2-[[3-(4-phenylpiperazino)propylcarbamoylamino]methyl]butyric acid Formula: C19H30N4O3 MolecularWeight: 362.4665

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)NCCCN1CCN(CC1)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCC(CNC(=O)NCCCN1CCN(CC1)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C19H30N4O3/c1-2-16(18(24)25)15-21-19(26)20-9-6-10-22-11-13-23(14-12-22)17-7-4-3-5-8-17/h3-5,7-8,16H,2,6,9-15H2,1H3,(H,24,25)(H2,20,21,26)