2-azanyl-4-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile

Systemtic Name: 2-azanyl-4-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile Openeye Name: 2-amino-4-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile CAS Name: 2-amino-4-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile IUPAC Name: 2-amino-4-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile Traditional Name: 2-amino-4-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile Formula: C19H22N3O3+ MolecularWeight: 340.39628

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=C(C(=[NH+]C3=C2CCCC3)N)C#N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C(C(=[NH+]C3=C2CCCC3)N)C#N

InChI

InChI=1S/C19H21N3O3/c1-23-15-8-11(9-16(24-2)18(15)25-3)17-12-6-4-5-7-14(12)22-19(21)13(17)10-20/h8-9H,4-7H2,1-3H3,(H2,21,22)/p+1