2-[(2R)-2-[2-(3-methylbutoxy)-2-oxidanylidene-ethyl]-3-oxidanylidene-piperazin-1-yl]carbonylbenzoic acid

Systemtic Name: 2-[(2R)-2-[2-(3-methylbutoxy)-2-oxidanylidene-ethyl]-3-oxidanylidene-piperazin-1-yl]carbonylbenzoic acid Openeye Name: 2-[(2R)-2-(2-isopentyloxy-2-oxo-ethyl)-3-oxo-piperazine-1-carbonyl]benzoic acid CAS Name: 2-[[(2R)-2-[2-(3-methylbutoxy)-2-oxoethyl]-3-oxo-1-piperazinyl]-oxomethyl]benzoic acid IUPAC Name: 2-[(2R)-2-[2-(3-methylbutoxy)-2-oxoethyl]-3-oxopiperazine-1-carbonyl]benzoic acid Traditional Name: 2-[(2R)-2-(2-isoamoxy-2-keto-ethyl)-3-keto-piperazine-1-carbonyl]benzoic acid Formula: C19H24N2O6 MolecularWeight: 376.40366

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC=CC=C2C(=O)O

Isomeric SMILES

CC(C)CCOC(=O)C[C@@H]1C(=O)NCCN1C(=O)C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C19H24N2O6/c1-12(2)7-10-27-16(22)11-15-17(23)20-8-9-21(15)18(24)13-5-3-4-6-14(13)19(25)26/h3-6,12,15H,7-11H2,1-2H3,(H,20,23)(H,25,26)/t15-/m1/s1