7-[2-(3-methoxy-4-oxidanyl-phenyl)ethylamino]quinoline-5,8-dione

Systemtic Name: 7-[2-(3-methoxy-4-oxidanyl-phenyl)ethylamino]quinoline-5,8-dione Openeye Name: 7-[2-(4-hydroxy-3-methoxy-phenyl)ethylamino]quinoline-5,8-dione CAS Name: 7-[2-(4-hydroxy-3-methoxyphenyl)ethylamino]quinoline-5,8-dione IUPAC Name: 7-[2-(4-hydroxy-3-methoxyphenyl)ethylamino]quinoline-5,8-dione Traditional Name: 7-(homovanillylamino)quinoline-5,8-quinone Formula: C18H16N2O4 MolecularWeight: 324.33064

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CCNC2=CC(=O)C3=C(C2=O)N=CC=C3)O

Isomeric SMILES

COC1=C(C=CC(=C1)CCNC2=CC(=O)C3=C(C2=O)N=CC=C3)O

InChI

InChI=1S/C18H16N2O4/c1-24-16-9-11(4-5-14(16)21)6-8-19-13-10-15(22)12-3-2-7-20-17(12)18(13)23/h2-5,7,9-10,19,21H,6,8H2,1H3