(2S,3S)-2-[(4-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-methyl-pentanoic acid

Systemtic Name: (2S,3S)-2-[(4-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-methyl-pentanoic acid Openeye Name: (2S,3S)-2-[(4-methoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-methyl-pentanoic acid CAS Name: (2S,3S)-2-[(4-methoxy-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-3-methylpentanoic acid IUPAC Name: (2S,3S)-2-[(4-methoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-3-methylpentanoic acid Traditional Name: (2S,3S)-2-[(6-keto-4-methoxy-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-methyl-valeric acid Formula: C14H19NO4 MolecularWeight: 265.30496

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC=C1C=CC(=CC1=O)OC

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)O)NC=C1C=CC(=CC1=O)OC

InChI

InChI=1S/C14H19NO4/c1-4-9(2)13(14(17)18)15-8-10-5-6-11(19-3)7-12(10)16/h5-9,13,15H,4H2,1-3H3,(H,17,18)/t9-,13-/m0/s1