2-[2-[4-[(4-ethylphenyl)methyl]piperazin-1-yl]ethanoylamino]butanedioic acid

Systemtic Name: 2-[2-[4-[(4-ethylphenyl)methyl]piperazin-1-yl]ethanoylamino]butanedioic acid Openeye Name: 2-[[2-[4-[(4-ethylphenyl)methyl]piperazin-1-yl]acetyl]amino]butanedioic acid CAS Name: 2-[[2-[4-[(4-ethylphenyl)methyl]-1-piperazinyl]-1-oxoethyl]amino]butanedioic acid IUPAC Name: 2-[[2-[4-[(4-ethylphenyl)methyl]piperazin-1-yl]acetyl]amino]butanedioic acid Traditional Name: 2-[[2-[4-(4-ethylbenzyl)piperazino]acetyl]amino]succinic acid Formula: C19H27N3O5 MolecularWeight: 377.43478

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2CCN(CC2)CC(=O)NC(CC(=O)O)C(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)CN2CCN(CC2)CC(=O)NC(CC(=O)O)C(=O)O

InChI

InChI=1S/C19H27N3O5/c1-2-14-3-5-15(6-4-14)12-21-7-9-22(10-8-21)13-17(23)20-16(19(26)27)11-18(24)25/h3-6,16H,2,7-13H2,1H3,(H,20,23)(H,24,25)(H,26,27)