5-methyl-1-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]indole-2,3-dione

Systemtic Name: 5-methyl-1-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]indole-2,3-dione Openeye Name: 5-methyl-1-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]indoline-2,3-dione CAS Name: 5-methyl-1-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]indole-2,3-dione IUPAC Name: 5-methyl-1-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]indole-2,3-dione Traditional Name: 5-methyl-1-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]isatin Formula: C21H21N2O2+ MolecularWeight: 333.40364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)C2=O)C[NH+]3CCC(=CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)C2=O)C[NH+]3CCC(=CC3)C4=CC=CC=C4

InChI

InChI=1S/C21H20N2O2/c1-15-7-8-19-18(13-15)20(24)21(25)23(19)14-22-11-9-17(10-12-22)16-5-3-2-4-6-16/h2-9,13H,10-12,14H2,1H3/p+1