(2S)-2-[[4-methoxy-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]amino]-3-oxidanyl-propanoic acid

Systemtic Name: (2S)-2-[[4-methoxy-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]amino]-3-oxidanyl-propanoic acid Openeye Name: (2S)-3-hydroxy-2-[(4-methoxy-3,6-dioxo-cyclohexa-1,4-dien-1-yl)amino]propanoic acid CAS Name: (2S)-3-hydroxy-2-[(4-methoxy-3,6-dioxo-1-cyclohexa-1,4-dienyl)amino]propanoic acid IUPAC Name: (2S)-3-hydroxy-2-[(4-methoxy-3,6-dioxocyclohexa-1,4-dien-1-yl)amino]propanoic acid Traditional Name: (2S)-2-[(3,6-diketo-4-methoxy-cyclohexa-1,4-dien-1-yl)amino]-3-hydroxy-propionic acid Formula: C10H11NO6 MolecularWeight: 241.19744

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=O)C(=CC1=O)NC(CO)C(=O)O

Isomeric SMILES

COC1=CC(=O)C(=CC1=O)N[C@@H](CO)C(=O)O

InChI

InChI=1S/C10H11NO6/c1-17-9-3-7(13)5(2-8(9)14)11-6(4-12)10(15)16/h2-3,6,11-12H,4H2,1H3,(H,15,16)/t6-/m0/s1