5-[5-methyl-2,3-bis(oxidanylidene)indol-1-yl]pentanoic acid

Systemtic Name: 5-[5-methyl-2,3-bis(oxidanylidene)indol-1-yl]pentanoic acid Openeye Name: 5-(5-methyl-2,3-dioxo-indolin-1-yl)pentanoic acid CAS Name: 5-(5-methyl-2,3-dioxo-1-indolyl)pentanoic acid IUPAC Name: 5-(5-methyl-2,3-dioxoindol-1-yl)pentanoic acid Traditional Name: 5-(2,3-diketo-5-methyl-indolin-1-yl)valeric acid Formula: C14H15NO4 MolecularWeight: 261.2732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)C2=O)CCCCC(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)C2=O)CCCCC(=O)O

InChI

InChI=1S/C14H15NO4/c1-9-5-6-11-10(8-9)13(18)14(19)15(11)7-3-2-4-12(16)17/h5-6,8H,2-4,7H2,1H3,(H,16,17)