(4-oxidanylidene-3-phenoxy-chromen-7-yl) 2,6-bis(azanyl)hexanoate

Systemtic Name: (4-oxidanylidene-3-phenoxy-chromen-7-yl) 2,6-bis(azanyl)hexanoate Openeye Name: (4-oxo-3-phenoxy-chromen-7-yl) 2,6-diaminohexanoate CAS Name: 2,6-diaminohexanoic acid (4-oxo-3-phenoxy-1-benzopyran-7-yl) ester IUPAC Name: (4-oxo-3-phenoxychromen-7-yl) 2,6-diaminohexanoate Traditional Name: 2,6-diaminohexanoic acid (4-keto-3-phenoxy-chromen-7-yl) ester Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=COC3=C(C2=O)C=CC(=C3)OC(=O)C(CCCCN)N

Isomeric SMILES

C1=CC=C(C=C1)OC2=COC3=C(C2=O)C=CC(=C3)OC(=O)C(CCCCN)N

InChI

InChI=1S/C21H22N2O5/c22-11-5-4-8-17(23)21(25)28-15-9-10-16-18(12-15)26-13-19(20(16)24)27-14-6-2-1-3-7-14/h1-3,6-7,9-10,12-13,17H,4-5,8,11,22-23H2