2-[(4-oxidanyl-7-propoxy-isoquinolin-3-yl)carbonylamino]ethanoic acid

Systemtic Name: 2-[(4-oxidanyl-7-propoxy-isoquinolin-3-yl)carbonylamino]ethanoic acid Openeye Name: 2-[(4-hydroxy-7-propoxy-isoquinoline-3-carbonyl)amino]acetic acid CAS Name: 2-[[(4-hydroxy-7-propoxy-3-isoquinolinyl)-oxomethyl]amino]acetic acid IUPAC Name: 2-[(4-hydroxy-7-propoxyisoquinoline-3-carbonyl)amino]acetic acid Traditional Name: 2-[(4-hydroxy-7-propoxy-isoquinoline-3-carbonyl)amino]acetic acid Formula: C15H16N2O5 MolecularWeight: 304.29794

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC2=CN=C(C(=C2C=C1)O)C(=O)NCC(=O)O

Isomeric SMILES

CCCOC1=CC2=CN=C(C(=C2C=C1)O)C(=O)NCC(=O)O

InChI

InChI=1S/C15H16N2O5/c1-2-5-22-10-3-4-11-9(6-10)7-16-13(14(11)20)15(21)17-8-12(18)19/h3-4,6-7,20H,2,5,8H2,1H3,(H,17,21)(H,18,19)