N-[(3-bromophenyl)methylideneamino]-4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)benzamide

Systemtic Name: N-[(3-bromophenyl)methylideneamino]-4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)benzamide Openeye Name: N-[(3-bromophenyl)methyleneamino]-4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)benzamide CAS Name: N-[(3-bromophenyl)methylideneamino]-4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)benzamide IUPAC Name: N-[(3-bromophenyl)methylideneamino]-4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)benzamide Traditional Name: N-[(3-bromobenzylidene)amino]-4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)benzamide Formula: C24H23BrN3O+ MolecularWeight: 449.36292

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC2=CC=CC=C21)CC3=CC=C(C=C3)C(=O)NN=CC4=CC(=CC=C4)Br

Isomeric SMILES

C1C[NH+](CC2=CC=CC=C21)CC3=CC=C(C=C3)C(=O)NN=CC4=CC(=CC=C4)Br

InChI

InChI=1S/C24H22BrN3O/c25-23-7-3-4-19(14-23)15-26-27-24(29)21-10-8-18(9-11-21)16-28-13-12-20-5-1-2-6-22(20)17-28/h1-11,14-15H,12-13,16-17H2,(H,27,29)/p+1