6-bromanyl-3-[(4-ethoxyphenyl)amino]-5-methyl-indol-1-ium-2-one

Systemtic Name: 6-bromanyl-3-[(4-ethoxyphenyl)amino]-5-methyl-indol-1-ium-2-one Openeye Name: 6-bromo-3-(4-ethoxyanilino)-5-methyl-indol-1-ium-2-one CAS Name: 6-bromo-3-(4-ethoxyanilino)-5-methyl-2-indol-1-iumone IUPAC Name: 6-bromo-3-(4-ethoxyanilino)-5-methylindol-1-ium-2-one Traditional Name: 6-bromo-5-methyl-3-(p-phenetidino)indol-1-ium-2-one Formula: C17H16BrN2O2+ MolecularWeight: 360.22514

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=C3C=C(C(=CC3=[NH+]C2=O)Br)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=C3C=C(C(=CC3=[NH+]C2=O)Br)C

InChI

InChI=1S/C17H15BrN2O2/c1-3-22-12-6-4-11(5-7-12)19-16-13-8-10(2)14(18)9-15(13)20-17(16)21/h4-9H,3H2,1-2H3,(H,19,20,21)/p+1