N,1-bis(3-methoxypropyl)-2-phenyl-5,6,7,8-tetrahydroquinazolin-1-ium-4-amine

Systemtic Name: N,1-bis(3-methoxypropyl)-2-phenyl-5,6,7,8-tetrahydroquinazolin-1-ium-4-amine Openeye Name: N,1-bis(3-methoxypropyl)-2-phenyl-5,6,7,8-tetrahydroquinazolin-1-ium-4-amine CAS Name: N,1-bis(3-methoxypropyl)-2-phenyl-5,6,7,8-tetrahydroquinazolin-1-ium-4-amine IUPAC Name: N,1-bis(3-methoxypropyl)-2-phenyl-5,6,7,8-tetrahydroquinazolin-1-ium-4-amine Traditional Name: 3-methoxypropyl-[1-(3-methoxypropyl)-2-phenyl-5,6,7,8-tetrahydroquinazolin-1-ium-4-yl]amine Formula: C22H32N3O2+ MolecularWeight: 370.50838

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC1=NC(=[N+](C2=C1CCCC2)CCCOC)C3=CC=CC=C3

Isomeric SMILES

COCCCNC1=NC(=[N+](C2=C1CCCC2)CCCOC)C3=CC=CC=C3

InChI

InChI=1S/C22H31N3O2/c1-26-16-8-14-23-21-19-12-6-7-13-20(19)25(15-9-17-27-2)22(24-21)18-10-4-3-5-11-18/h3-5,10-11H,6-9,12-17H2,1-2H3/p+1