5-[3-methyl-5-[(oxidanylcarbamoylamino)methyl]-2-pyridin-3-yl-indol-2-yl]pentanoic acid

Systemtic Name: 5-[3-methyl-5-[(oxidanylcarbamoylamino)methyl]-2-pyridin-3-yl-indol-2-yl]pentanoic acid Openeye Name: 5-[5-[(hydroxycarbamoylamino)methyl]-3-methyl-2-(3-pyridyl)indol-2-yl]pentanoic acid CAS Name: 5-[5-[[[(hydroxyamino)-oxomethyl]amino]methyl]-3-methyl-2-(3-pyridinyl)-2-indolyl]pentanoic acid IUPAC Name: 5-[5-[(hydroxycarbamoylamino)methyl]-3-methyl-2-pyridin-3-ylindol-2-yl]pentanoic acid Traditional Name: 5-[5-[(hydroxycarbamoylamino)methyl]-3-methyl-2-(3-pyridyl)indol-2-yl]valeric acid Formula: C21H24N4O4 MolecularWeight: 396.43966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C=CC2=NC1(CCCCC(=O)O)C3=CN=CC=C3)CNC(=O)NO

Isomeric SMILES

CC1=C2C=C(C=CC2=NC1(CCCCC(=O)O)C3=CN=CC=C3)CNC(=O)NO

InChI

InChI=1S/C21H24N4O4/c1-14-17-11-15(12-23-20(28)25-29)7-8-18(17)24-21(14,9-3-2-6-19(26)27)16-5-4-10-22-13-16/h4-5,7-8,10-11,13,29H,2-3,6,9,12H2,1H3,(H,26,27)(H2,23,25,28)