2-azanyl-4-[3-[(2-chloranylphenoxy)methyl]-4-methoxy-phenyl]-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile

Systemtic Name: 2-azanyl-4-[3-[(2-chloranylphenoxy)methyl]-4-methoxy-phenyl]-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile Openeye Name: 2-amino-4-[3-[(2-chlorophenoxy)methyl]-4-methoxy-phenyl]-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile CAS Name: 2-amino-4-[3-[(2-chlorophenoxy)methyl]-4-methoxyphenyl]-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile IUPAC Name: 2-amino-4-[3-[(2-chlorophenoxy)methyl]-4-methoxyphenyl]-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile Traditional Name: 2-amino-4-[3-[(2-chlorophenoxy)methyl]-4-methoxy-phenyl]-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile Formula: C24H23ClN3O2+ MolecularWeight: 420.91132

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C(=[NH+]C3=C2CCCC3)N)C#N)COC4=CC=CC=C4Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C(=[NH+]C3=C2CCCC3)N)C#N)COC4=CC=CC=C4Cl

InChI

InChI=1S/C24H22ClN3O2/c1-29-21-11-10-15(12-16(21)14-30-22-9-5-3-7-19(22)25)23-17-6-2-4-8-20(17)28-24(27)18(23)13-26/h3,5,7,9-12H,2,4,6,8,14H2,1H3,(H2,27,28)/p+1