2-[[1,3-bis(oxidanylidene)-2-pyridin-2-yl-isoquinolin-4-ylidene]methylamino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[[1,3-bis(oxidanylidene)-2-pyridin-2-yl-isoquinolin-4-ylidene]methylamino]ethyl-di(propan-2-yl)azanium Openeye Name: 2-[[1,3-dioxo-2-(2-pyridyl)-4-isoquinolylidene]methylamino]ethyl-diisopropyl-ammonium CAS Name: 2-[[1,3-dioxo-2-(2-pyridinyl)-4-isoquinolinylidene]methylamino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[(1,3-dioxo-2-pyridin-2-ylisoquinolin-4-ylidene)methylamino]ethyl-di(propan-2-yl)azanium Traditional Name: 2-[[1,3-diketo-2-(2-pyridyl)-4-isoquinolylidene]methylamino]ethyl-diisopropyl-ammonium Formula: C23H29N4O2+ MolecularWeight: 393.50196

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCNC=C1C2=CC=CC=C2C(=O)N(C1=O)C3=CC=CC=N3)C(C)C

Isomeric SMILES

CC(C)[NH+](CCNC=C1C2=CC=CC=C2C(=O)N(C1=O)C3=CC=CC=N3)C(C)C

InChI

InChI=1S/C23H28N4O2/c1-16(2)26(17(3)4)14-13-24-15-20-18-9-5-6-10-19(18)22(28)27(23(20)29)21-11-7-8-12-25-21/h5-12,15-17,24H,13-14H2,1-4H3/p+1