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

Systemtic Name: 3-[(3,5-dimethylphenyl)amino]indol-1-ium-2-one Openeye Name: 3-(3,5-dimethylanilino)indol-1-ium-2-one CAS Name: 3-(3,5-dimethylanilino)-2-indol-1-iumone IUPAC Name: 3-(3,5-dimethylanilino)indol-1-ium-2-one Traditional Name: 3-(3,5-dimethylanilino)indol-1-ium-2-one Formula: C16H15N2O+ MolecularWeight: 251.3031

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC2=C3C=CC=CC3=[NH+]C2=O)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC2=C3C=CC=CC3=[NH+]C2=O)C

InChI

InChI=1S/C16H14N2O/c1-10-7-11(2)9-12(8-10)17-15-13-5-3-4-6-14(13)18-16(15)19/h3-9H,1-2H3,(H,17,18,19)/p+1