[(4S)-1-(6-ethoxy-4-methyl-quinazolin-2-yl)azepan-4-yl]-methyl-[(3-methylpyridin-4-yl)methyl]azanium

Systemtic Name: [(4S)-1-(6-ethoxy-4-methyl-quinazolin-2-yl)azepan-4-yl]-methyl-[(3-methylpyridin-4-yl)methyl]azanium Openeye Name: [(4S)-1-(6-ethoxy-4-methyl-quinazolin-2-yl)azepan-4-yl]-methyl-[(3-methyl-4-pyridyl)methyl]ammonium CAS Name: [(4S)-1-(6-ethoxy-4-methyl-2-quinazolinyl)-4-azepanyl]-methyl-[(3-methyl-4-pyridinyl)methyl]ammonium IUPAC Name: [(4S)-1-(6-ethoxy-4-methylquinazolin-2-yl)azepan-4-yl]-methyl-[(3-methylpyridin-4-yl)methyl]azanium Traditional Name: [(4S)-1-(6-ethoxy-4-methyl-quinazolin-2-yl)azepan-4-yl]-methyl-[(3-methyl-4-pyridyl)methyl]ammonium Formula: C25H34N5O+ MolecularWeight: 420.57036

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(N=C2C)N3CCCC(CC3)[NH+](C)CC4=C(C=NC=C4)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(N=C2C)N3CCC[C@@H](CC3)[NH+](C)CC4=C(C=NC=C4)C

InChI

InChI=1S/C25H33N5O/c1-5-31-22-8-9-24-23(15-22)19(3)27-25(28-24)30-13-6-7-21(11-14-30)29(4)17-20-10-12-26-16-18(20)2/h8-10,12,15-16,21H,5-7,11,13-14,17H2,1-4H3/p+1/t21-/m0/s1