2-(2-methyl-5-oxidanyl-1-piperazin-1-ylcarbonyl-indol-3-yl)ethanoic acid

Systemtic Name: 2-(2-methyl-5-oxidanyl-1-piperazin-1-ylcarbonyl-indol-3-yl)ethanoic acid Openeye Name: 2-[5-hydroxy-2-methyl-1-(piperazine-1-carbonyl)indol-3-yl]acetic acid CAS Name: 2-[5-hydroxy-2-methyl-1-[oxo(1-piperazinyl)methyl]-3-indolyl]acetic acid IUPAC Name: 2-[5-hydroxy-2-methyl-1-(piperazine-1-carbonyl)indol-3-yl]acetic acid Traditional Name: 2-[5-hydroxy-2-methyl-1-(piperazine-1-carbonyl)indol-3-yl]acetic acid Formula: C16H19N3O4 MolecularWeight: 317.33976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C(=O)N3CCNCC3)C=CC(=C2)O)CC(=O)O

Isomeric SMILES

CC1=C(C2=C(N1C(=O)N3CCNCC3)C=CC(=C2)O)CC(=O)O

InChI

InChI=1S/C16H19N3O4/c1-10-12(9-15(21)22)13-8-11(20)2-3-14(13)19(10)16(23)18-6-4-17-5-7-18/h2-3,8,17,20H,4-7,9H2,1H3,(H,21,22)