N-(1H-indol-5-yl)-7-methoxy-6-(1-oxidanidylpyridin-1-ium-3-yl)quinazolin-4-amine

Systemtic Name: N-(1H-indol-5-yl)-7-methoxy-6-(1-oxidanidylpyridin-1-ium-3-yl)quinazolin-4-amine Openeye Name: N-(1H-indol-5-yl)-7-methoxy-6-(1-oxidopyridin-1-ium-3-yl)quinazolin-4-amine CAS Name: N-(1H-indol-5-yl)-7-methoxy-6-(1-oxido-3-pyridin-1-iumyl)-4-quinazolinamine IUPAC Name: N-(1H-indol-5-yl)-7-methoxy-6-(1-oxidopyridin-1-ium-3-yl)quinazolin-4-amine Traditional Name: 1H-indol-5-yl-[7-methoxy-6-(1-oxidopyridin-1-ium-3-yl)quinazolin-4-yl]amine Formula: C22H17N5O2 MolecularWeight: 383.40268

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=CN=C2NC3=CC4=C(C=C3)NC=C4)C5=C[N+](=CC=C5)[O-]

Isomeric SMILES

COC1=C(C=C2C(=C1)N=CN=C2NC3=CC4=C(C=C3)NC=C4)C5=C[N+](=CC=C5)[O-]

InChI

InChI=1S/C22H17N5O2/c1-29-21-11-20-18(10-17(21)15-3-2-8-27(28)12-15)22(25-13-24-20)26-16-4-5-19-14(9-16)6-7-23-19/h2-13,23H,1H3,(H,24,25,26)