[2-[(3,4-dimethylphenoxy)methyl]-5,6,7,8-tetrahydroquinazolin-4-yl]methylazanium

Systemtic Name: [2-[(3,4-dimethylphenoxy)methyl]-5,6,7,8-tetrahydroquinazolin-4-yl]methylazanium Openeye Name: [2-[(3,4-dimethylphenoxy)methyl]-5,6,7,8-tetrahydroquinazolin-4-yl]methylammonium CAS Name: [2-[(3,4-dimethylphenoxy)methyl]-5,6,7,8-tetrahydroquinazolin-4-yl]methylammonium IUPAC Name: [2-[(3,4-dimethylphenoxy)methyl]-5,6,7,8-tetrahydroquinazolin-4-yl]methylazanium Traditional Name: [2-[(3,4-dimethylphenoxy)methyl]-5,6,7,8-tetrahydroquinazolin-4-yl]methylammonium Formula: C18H24N3O+ MolecularWeight: 298.40266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC2=NC3=C(CCCC3)C(=N2)C[NH3+])C

Isomeric SMILES

CC1=C(C=C(C=C1)OCC2=NC3=C(CCCC3)C(=N2)C[NH3+])C

InChI

InChI=1S/C18H23N3O/c1-12-7-8-14(9-13(12)2)22-11-18-20-16-6-4-3-5-15(16)17(10-19)21-18/h7-9H,3-6,10-11,19H2,1-2H3/p+1