(2S)-2-[(3-oxidanyl-6-oxidanylidene-benzo[c]chromen-4-yl)methylamino]hexanoic acid

Systemtic Name: (2S)-2-[(3-oxidanyl-6-oxidanylidene-benzo[c]chromen-4-yl)methylamino]hexanoic acid Openeye Name: (2S)-2-[(3-hydroxy-6-oxo-benzo[c]chromen-4-yl)methylamino]hexanoic acid CAS Name: (2S)-2-[(3-hydroxy-6-oxo-4-benzo[c][1]benzopyranyl)methylamino]hexanoic acid IUPAC Name: (2S)-2-[(3-hydroxy-6-oxobenzo[c]chromen-4-yl)methylamino]hexanoic acid Traditional Name: (2S)-2-[(3-hydroxy-6-keto-benzo[c]chromen-4-yl)methylamino]hexanoic acid Formula: C20H21NO5 MolecularWeight: 355.38444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NCC1=C(C=CC2=C1OC(=O)C3=CC=CC=C23)O

Isomeric SMILES

CCCC[C@@H](C(=O)O)NCC1=C(C=CC2=C1OC(=O)C3=CC=CC=C23)O

InChI

InChI=1S/C20H21NO5/c1-2-3-8-16(19(23)24)21-11-15-17(22)10-9-13-12-6-4-5-7-14(12)20(25)26-18(13)15/h4-7,9-10,16,21-22H,2-3,8,11H2,1H3,(H,23,24)/t16-/m0/s1