3-[(3,4,5-trimethoxyphenyl)amino]indol-1-ium-2-one

Systemtic Name: 3-[(3,4,5-trimethoxyphenyl)amino]indol-1-ium-2-one Openeye Name: 3-(3,4,5-trimethoxyanilino)indol-1-ium-2-one CAS Name: 3-(3,4,5-trimethoxyanilino)-2-indol-1-iumone IUPAC Name: 3-(3,4,5-trimethoxyanilino)indol-1-ium-2-one Traditional Name: 3-(3,4,5-trimethoxyanilino)indol-1-ium-2-one Formula: C17H17N2O4+ MolecularWeight: 313.32788

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC2=C3C=CC=CC3=[NH+]C2=O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC2=C3C=CC=CC3=[NH+]C2=O

InChI

InChI=1S/C17H16N2O4/c1-21-13-8-10(9-14(22-2)16(13)23-3)18-15-11-6-4-5-7-12(11)19-17(15)20/h4-9H,1-3H3,(H,18,19,20)/p+1