1-(9-methoxy-5,6-dihydrobenzo[h]quinazolin-2-yl)-N,5-dimethyl-N-(1-methylpiperidin-1-ium-4-yl)pyrazole-4-carboxamide

Systemtic Name: 1-(9-methoxy-5,6-dihydrobenzo[h]quinazolin-2-yl)-N,5-dimethyl-N-(1-methylpiperidin-1-ium-4-yl)pyrazole-4-carboxamide Openeye Name: 1-(9-methoxy-5,6-dihydrobenzo[h]quinazolin-2-yl)-N,5-dimethyl-N-(1-methylpiperidin-1-ium-4-yl)pyrazole-4-carboxamide CAS Name: 1-(9-methoxy-5,6-dihydrobenzo[h]quinazolin-2-yl)-N,5-dimethyl-N-(1-methyl-4-piperidin-1-iumyl)-4-pyrazolecarboxamide IUPAC Name: 1-(9-methoxy-5,6-dihydrobenzo[h]quinazolin-2-yl)-N,5-dimethyl-N-(1-methylpiperidin-1-ium-4-yl)pyrazole-4-carboxamide Traditional Name: 1-(9-methoxy-5,6-dihydrobenzo[h]quinazolin-2-yl)-N,5-dimethyl-N-(1-methylpiperidin-1-ium-4-yl)pyrazole-4-carboxamide Formula: C25H31N6O2+ MolecularWeight: 447.55264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=NC=C3CCC4=C(C3=N2)C=C(C=C4)OC)C(=O)N(C)C5CC[NH+](CC5)C

Isomeric SMILES

CC1=C(C=NN1C2=NC=C3CCC4=C(C3=N2)C=C(C=C4)OC)C(=O)N(C)C5CC[NH+](CC5)C

InChI

InChI=1S/C25H30N6O2/c1-16-22(24(32)30(3)19-9-11-29(2)12-10-19)15-27-31(16)25-26-14-18-6-5-17-7-8-20(33-4)13-21(17)23(18)28-25/h7-8,13-15,19H,5-6,9-12H2,1-4H3/p+1