2-methylidene-5-(phenylcarbamoylamino)pentanoic acid; 2-methylidene-5-(propylcarbamoylamino)pentanoate

Systemtic Name: 2-methylidene-5-(phenylcarbamoylamino)pentanoic acid; 2-methylidene-5-(propylcarbamoylamino)pentanoate Openeye Name: 2-methylene-5-(phenylcarbamoylamino)pentanoic acid; 2-methylene-5-(propylcarbamoylamino)pentanoate CAS Name: 5-[[anilino(oxo)methyl]amino]-2-methylenepentanoic acid; 2-methylene-5-[[oxo(propylamino)methyl]amino]pentanoate IUPAC Name: 2-methylidene-5-(phenylcarbamoylamino)pentanoic acid; 2-methylidene-5-(propylcarbamoylamino)pentanoate Traditional Name: 2-[3-(phenylcarbamoylamino)propyl]acrylic acid; 2-[3-(propylcarbamoylamino)propyl]acrylate Formula: C23H33N4O6- MolecularWeight: 461.53132

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NCCCC(=C)C(=O)[O-].C=C(CCCNC(=O)NC1=CC=CC=C1)C(=O)O

Isomeric SMILES

CCCNC(=O)NCCCC(=C)C(=O)[O-].C=C(CCCNC(=O)NC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C13H16N2O3.C10H18N2O3/c1-10(12(16)17)6-5-9-14-13(18)15-11-7-3-2-4-8-11;1-3-6-11-10(15)12-7-4-5-8(2)9(13)14/h2-4,7-8H,1,5-6,9H2,(H,16,17)(H2,14,15,18);2-7H2,1H3,(H,13,14)(H2,11,12,15)/p-1