5,5-dimethyl-2-(pyrrolidin-1-ium-1-ylmethyl)-1,6-dihydrobenzo[h]quinazolin-4-one

Systemtic Name: 5,5-dimethyl-2-(pyrrolidin-1-ium-1-ylmethyl)-1,6-dihydrobenzo[h]quinazolin-4-one Openeye Name: 5,5-dimethyl-2-(pyrrolidin-1-ium-1-ylmethyl)-1,6-dihydrobenzo[h]quinazolin-4-one CAS Name: 5,5-dimethyl-2-(1-pyrrolidin-1-iumylmethyl)-1,6-dihydrobenzo[h]quinazolin-4-one IUPAC Name: 5,5-dimethyl-2-(pyrrolidin-1-ium-1-ylmethyl)-1,6-dihydrobenzo[h]quinazolin-4-one Traditional Name: 5,5-dimethyl-2-(pyrrolidin-1-ium-1-ylmethyl)-1,6-dihydrobenzo[h]quinazolin-4-one Formula: C19H24N3O+ MolecularWeight: 310.41336

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C3=C1C(=O)N=C(N3)C[NH+]4CCCC4)C

Isomeric SMILES

CC1(CC2=CC=CC=C2C3=C1C(=O)N=C(N3)C[NH+]4CCCC4)C

InChI

InChI=1S/C19H23N3O/c1-19(2)11-13-7-3-4-8-14(13)17-16(19)18(23)21-15(20-17)12-22-9-5-6-10-22/h3-4,7-8H,5-6,9-12H2,1-2H3,(H,20,21,23)/p+1