4-[(2-methyl-2-morpholin-4-ium-4-yl-propyl)iminomethyl]-2-pyridin-2-yl-4H-isoquinoline-1,3-dione

Systemtic Name: 4-[(2-methyl-2-morpholin-4-ium-4-yl-propyl)iminomethyl]-2-pyridin-2-yl-4H-isoquinoline-1,3-dione Openeye Name: 4-[(2-methyl-2-morpholin-4-ium-4-yl-propyl)iminomethyl]-2-(2-pyridyl)-4H-isoquinoline-1,3-dione CAS Name: 4-[[2-methyl-2-(4-morpholin-4-iumyl)propyl]iminomethyl]-2-(2-pyridinyl)-4H-isoquinoline-1,3-dione IUPAC Name: 4-[(2-methyl-2-morpholin-4-ium-4-ylpropyl)iminomethyl]-2-pyridin-2-yl-4H-isoquinoline-1,3-dione Traditional Name: 4-[(2-methyl-2-morpholin-4-ium-4-yl-propyl)iminomethyl]-2-(2-pyridyl)-4H-isoquinoline-1,3-quinone Formula: C23H27N4O3+ MolecularWeight: 407.48548

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN=CC1C2=CC=CC=C2C(=O)N(C1=O)C3=CC=CC=N3)[NH+]4CCOCC4

Isomeric SMILES

CC(C)(CN=CC1C2=CC=CC=C2C(=O)N(C1=O)C3=CC=CC=N3)[NH+]4CCOCC4

InChI

InChI=1S/C23H26N4O3/c1-23(2,26-11-13-30-14-12-26)16-24-15-19-17-7-3-4-8-18(17)21(28)27(22(19)29)20-9-5-6-10-25-20/h3-10,15,19H,11-14,16H2,1-2H3/p+1