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

Systemtic Name: 6-bromanyl-3-[[4-(diethylamino)phenyl]amino]-5-methyl-indol-1-ium-2-one Openeye Name: 6-bromo-3-[4-(diethylamino)anilino]-5-methyl-indol-1-ium-2-one CAS Name: 6-bromo-3-[4-(diethylamino)anilino]-5-methyl-2-indol-1-iumone IUPAC Name: 6-bromo-3-[4-(diethylamino)anilino]-5-methylindol-1-ium-2-one Traditional Name: 6-bromo-3-[4-(diethylamino)anilino]-5-methyl-indol-1-ium-2-one Formula: C19H21BrN3O+ MolecularWeight: 387.29354

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20BrN3O/c1-4-23(5-2)14-8-6-13(7-9-14)21-18-15-10-12(3)16(20)11-17(15)22-19(18)24/h6-11H,4-5H2,1-3H3,(H,21,22,24)/p+1