[1,2-dimethyl-1-(2-morpholin-4-ylethyl)indol-1-ium-3-yl]-(4-nitrophenyl)methanone

Systemtic Name: [1,2-dimethyl-1-(2-morpholin-4-ylethyl)indol-1-ium-3-yl]-(4-nitrophenyl)methanone Openeye Name: [1,2-dimethyl-1-(2-morpholinoethyl)indol-1-ium-3-yl]-(4-nitrophenyl)methanone CAS Name: [1,2-dimethyl-1-[2-(4-morpholinyl)ethyl]-3-indol-1-iumyl]-(4-nitrophenyl)methanone IUPAC Name: [1,2-dimethyl-1-(2-morpholin-4-ylethyl)indol-1-ium-3-yl]-(4-nitrophenyl)methanone Traditional Name: [1,2-dimethyl-1-(2-morpholinoethyl)indol-1-ium-3-yl]-(4-nitrophenyl)methanone Formula: C23H26N3O4+ MolecularWeight: 408.47024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2[N+]1(C)CCN3CCOCC3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C2=CC=CC=C2[N+]1(C)CCN3CCOCC3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H26N3O4/c1-17-22(23(27)18-7-9-19(10-8-18)25(28)29)20-5-3-4-6-21(20)26(17,2)14-11-24-12-15-30-16-13-24/h3-10H,11-16H2,1-2H3/q+1