6-ethoxy-4-methyl-2-[4-[(2,3,4-trimethoxyphenyl)methyl]-1,4-diazepan-4-ium-1-yl]quinazoline

Systemtic Name: 6-ethoxy-4-methyl-2-[4-[(2,3,4-trimethoxyphenyl)methyl]-1,4-diazepan-4-ium-1-yl]quinazoline Openeye Name: 6-ethoxy-4-methyl-2-[4-[(2,3,4-trimethoxyphenyl)methyl]-1,4-diazepan-4-ium-1-yl]quinazoline CAS Name: 6-ethoxy-4-methyl-2-[4-[(2,3,4-trimethoxyphenyl)methyl]-1,4-diazepan-4-ium-1-yl]quinazoline IUPAC Name: 6-ethoxy-4-methyl-2-[4-[(2,3,4-trimethoxyphenyl)methyl]-1,4-diazepan-4-ium-1-yl]quinazoline Traditional Name: 6-ethoxy-4-methyl-2-[4-(2,3,4-trimethoxybenzyl)-1,4-diazepan-4-ium-1-yl]quinazoline Formula: C26H35N4O4+ MolecularWeight: 467.5805

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H34N4O4/c1-6-34-20-9-10-22-21(16-20)18(2)27-26(28-22)30-13-7-12-29(14-15-30)17-19-8-11-23(31-3)25(33-5)24(19)32-4/h8-11,16H,6-7,12-15,17H2,1-5H3/p+1