[1-[(6,7-dimethoxy-4-pyrrolidin-1-yl-quinazolin-2-yl)methyl]piperidin-1-ium-4-yl]-piperidin-1-yl-methanone

Systemtic Name: [1-[(6,7-dimethoxy-4-pyrrolidin-1-yl-quinazolin-2-yl)methyl]piperidin-1-ium-4-yl]-piperidin-1-yl-methanone Openeye Name: [1-[(6,7-dimethoxy-4-pyrrolidin-1-yl-quinazolin-2-yl)methyl]piperidin-1-ium-4-yl]-(1-piperidyl)methanone CAS Name: [1-[[6,7-dimethoxy-4-(1-pyrrolidinyl)-2-quinazolinyl]methyl]-4-piperidin-1-iumyl]-(1-piperidinyl)methanone IUPAC Name: [1-[(6,7-dimethoxy-4-pyrrolidin-1-ylquinazolin-2-yl)methyl]piperidin-1-ium-4-yl]-piperidin-1-ylmethanone Traditional Name: [1-[(6,7-dimethoxy-4-pyrrolidino-quinazolin-2-yl)methyl]piperidin-1-ium-4-yl]-piperidino-methanone Formula: C26H38N5O3+ MolecularWeight: 468.61162

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)C[NH+]3CCC(CC3)C(=O)N4CCCCC4)N5CCCC5)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)C[NH+]3CCC(CC3)C(=O)N4CCCCC4)N5CCCC5)OC

InChI

InChI=1S/C26H37N5O3/c1-33-22-16-20-21(17-23(22)34-2)27-24(28-25(20)30-10-6-7-11-30)18-29-14-8-19(9-15-29)26(32)31-12-4-3-5-13-31/h16-17,19H,3-15,18H2,1-2H3/p+1