6-[(2,4-dichlorophenyl)-piperazin-1-yl-methyl]isoquinoline

Systemtic Name: 6-[(2,4-dichlorophenyl)-piperazin-1-yl-methyl]isoquinoline Openeye Name: 6-[(2,4-dichlorophenyl)-piperazin-1-yl-methyl]isoquinoline CAS Name: 6-[(2,4-dichlorophenyl)-(1-piperazinyl)methyl]isoquinoline IUPAC Name: 6-[(2,4-dichlorophenyl)-piperazin-1-ylmethyl]isoquinoline Traditional Name: 6-[(2,4-dichlorophenyl)-piperazino-methyl]isoquinoline Formula: C20H19Cl2N3 MolecularWeight: 372.29096

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(C2=CC3=C(C=C2)C=NC=C3)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1CN(CCN1)C(C2=CC3=C(C=C2)C=NC=C3)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C20H19Cl2N3/c21-17-3-4-18(19(22)12-17)20(25-9-7-23-8-10-25)15-1-2-16-13-24-6-5-14(16)11-15/h1-6,11-13,20,23H,7-10H2