(2R)-2-[[2-(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)chromen-4-yl]amino]-3-methyl-butanoic acid

Systemtic Name: (2R)-2-[[2-(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)chromen-4-yl]amino]-3-methyl-butanoic acid Openeye Name: (2R)-2-[[2-(3-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)chromen-4-yl]amino]-3-methyl-butanoic acid CAS Name: (2R)-2-[[2-(3-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)-1-benzopyran-4-yl]amino]-3-methylbutanoic acid IUPAC Name: (2R)-2-[[2-(3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)chromen-4-yl]amino]-3-methylbutanoic acid Traditional Name: (2R)-2-[[2-(4-keto-3-methoxy-cyclohexa-2,5-dien-1-ylidene)chromen-4-yl]amino]-3-methyl-butyric acid Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC1=CC(=C2C=CC(=O)C(=C2)OC)OC3=CC=CC=C31

Isomeric SMILES

CC(C)[C@H](C(=O)O)NC1=CC(=C2C=CC(=O)C(=C2)OC)OC3=CC=CC=C31

InChI

InChI=1S/C21H21NO5/c1-12(2)20(21(24)25)22-15-11-18(27-17-7-5-4-6-14(15)17)13-8-9-16(23)19(10-13)26-3/h4-12,20,22H,1-3H3,(H,24,25)/t20-/m1/s1