2-[[2-(4-azanylbutanoyl)-6-(methylcarbamoyl)-1,3-dihydroisoindol-5-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[2-(4-azanylbutanoyl)-6-(methylcarbamoyl)-1,3-dihydroisoindol-5-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[2-(4-aminobutanoyl)-6-(methylcarbamoyl)isoindoline-5-carbonyl]amino]acetic acid CAS Name: 2-[[[2-(4-amino-1-oxobutyl)-6-(methylcarbamoyl)-1,3-dihydroisoindol-5-yl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[2-(4-aminobutanoyl)-6-(methylcarbamoyl)-1,3-dihydroisoindole-5-carbonyl]amino]acetic acid Traditional Name: 2-[[2-(4-aminobutanoyl)-6-(methylcarbamoyl)isoindoline-5-carbonyl]amino]acetic acid Formula: C17H22N4O5 MolecularWeight: 362.38038

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC2=C(CN(C2)C(=O)CCCN)C=C1C(=O)NCC(=O)O

Isomeric SMILES

CNC(=O)C1=CC2=C(CN(C2)C(=O)CCCN)C=C1C(=O)NCC(=O)O

InChI

InChI=1S/C17H22N4O5/c1-19-16(25)12-5-10-8-21(14(22)3-2-4-18)9-11(10)6-13(12)17(26)20-7-15(23)24/h5-6H,2-4,7-9,18H2,1H3,(H,19,25)(H,20,26)(H,23,24)