7-chloranyl-1-[4-[4-(3-methoxyphenyl)cyclohexyl]piperazin-1-yl]isoquinoline

Systemtic Name: 7-chloranyl-1-[4-[4-(3-methoxyphenyl)cyclohexyl]piperazin-1-yl]isoquinoline Openeye Name: 7-chloro-1-[4-[4-(3-methoxyphenyl)cyclohexyl]piperazin-1-yl]isoquinoline CAS Name: 7-chloro-1-[4-[4-(3-methoxyphenyl)cyclohexyl]-1-piperazinyl]isoquinoline IUPAC Name: 7-chloro-1-[4-[4-(3-methoxyphenyl)cyclohexyl]piperazin-1-yl]isoquinoline Traditional Name: 7-chloro-1-[4-[4-(3-methoxyphenyl)cyclohexyl]piperazino]isoquinoline Formula: C26H30ClN3O MolecularWeight: 435.9889

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2CCC(CC2)N3CCN(CC3)C4=NC=CC5=C4C=C(C=C5)Cl

Isomeric SMILES

COC1=CC=CC(=C1)C2CCC(CC2)N3CCN(CC3)C4=NC=CC5=C4C=C(C=C5)Cl

InChI

InChI=1S/C26H30ClN3O/c1-31-24-4-2-3-21(17-24)19-6-9-23(10-7-19)29-13-15-30(16-14-29)26-25-18-22(27)8-5-20(25)11-12-28-26/h2-5,8,11-12,17-19,23H,6-7,9-10,13-16H2,1H3