(6-methoxy-8-oxidanyl-1-oxidanylidene-isochromen-3-yl)methyl (2S)-2,6-bis(azanyl)hexanoate

Systemtic Name: (6-methoxy-8-oxidanyl-1-oxidanylidene-isochromen-3-yl)methyl (2S)-2,6-bis(azanyl)hexanoate Openeye Name: (8-hydroxy-6-methoxy-1-oxo-isochromen-3-yl)methyl (2S)-2,6-diaminohexanoate CAS Name: (2S)-2,6-diaminohexanoic acid (8-hydroxy-6-methoxy-1-oxo-2-benzopyran-3-yl)methyl ester IUPAC Name: (8-hydroxy-6-methoxy-1-oxoisochromen-3-yl)methyl (2S)-2,6-diaminohexanoate Traditional Name: (2S)-2,6-diaminohexanoic acid (8-hydroxy-1-keto-6-methoxy-isochromen-3-yl)methyl ester Formula: C17H22N2O6 MolecularWeight: 350.36638

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C(=C1)C=C(OC2=O)COC(=O)C(CCCCN)N)O

Isomeric SMILES

COC1=CC(=C2C(=C1)C=C(OC2=O)COC(=O)[C@H](CCCCN)N)O

InChI

InChI=1S/C17H22N2O6/c1-23-11-6-10-7-12(25-17(22)15(10)14(20)8-11)9-24-16(21)13(19)4-2-3-5-18/h6-8,13,20H,2-5,9,18-19H2,1H3/t13-/m0/s1