2-[1,8-diethyl-4-(oxidanylamino)-3H-pyrano[3,4-b]indol-1-yl]ethanoic acid

Systemtic Name: 2-[1,8-diethyl-4-(oxidanylamino)-3H-pyrano[3,4-b]indol-1-yl]ethanoic acid Openeye Name: 2-[1,8-diethyl-4-(hydroxyamino)-3H-pyrano[3,4-b]indol-1-yl]acetic acid CAS Name: 2-[1,8-diethyl-4-(hydroxyamino)-3H-pyrano[3,4-b]indol-1-yl]acetic acid IUPAC Name: 2-[1,8-diethyl-4-(hydroxyamino)-3H-pyrano[3,4-b]indol-1-yl]acetic acid Traditional Name: 2-[1,8-diethyl-4-(hydroxyamino)-3H-pyran[3,4-b]indol-1-yl]acetic acid Formula: C17H20N2O4 MolecularWeight: 316.3517

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1N=C3C2=C(COC3(CC)CC(=O)O)NO

Isomeric SMILES

CCC1=CC=CC2=C1N=C3C2=C(COC3(CC)CC(=O)O)NO

InChI

InChI=1S/C17H20N2O4/c1-3-10-6-5-7-11-14-12(19-22)9-23-17(4-2,8-13(20)21)16(14)18-15(10)11/h5-7,19,22H,3-4,8-9H2,1-2H3,(H,20,21)