ethyl 1-[1-(7-methoxy-4-methyl-quinazolin-2-yl)piperidin-4-yl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[1-(7-methoxy-4-methyl-quinazolin-2-yl)piperidin-4-yl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[1-(7-methoxy-4-methyl-quinazolin-2-yl)-4-piperidyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[1-(7-methoxy-4-methyl-2-quinazolinyl)-4-piperidinyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-(7-methoxy-4-methylquinazolin-2-yl)piperidin-4-yl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[1-(7-methoxy-4-methyl-quinazolin-2-yl)-4-piperidyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C23H33N4O3+ MolecularWeight: 413.53312

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)C2CCN(CC2)C3=NC4=C(C=CC(=C4)OC)C(=N3)C

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)C2CCN(CC2)C3=NC4=C(C=CC(=C4)OC)C(=N3)C

InChI

InChI=1S/C23H32N4O3/c1-4-30-22(28)17-7-11-26(12-8-17)18-9-13-27(14-10-18)23-24-16(2)20-6-5-19(29-3)15-21(20)25-23/h5-6,15,17-18H,4,7-14H2,1-3H3/p+1