5-[4-(4-chloranyl-1H-indol-3-yl)-3-(3,4-dihydro-1H-isoquinolin-2-yl)piperidin-1-yl]pentanal

Systemtic Name: 5-[4-(4-chloranyl-1H-indol-3-yl)-3-(3,4-dihydro-1H-isoquinolin-2-yl)piperidin-1-yl]pentanal Openeye Name: 5-[4-(4-chloro-1H-indol-3-yl)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-piperidyl]pentanal CAS Name: 5-[4-(4-chloro-1H-indol-3-yl)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-piperidinyl]pentanal IUPAC Name: 5-[4-(4-chloro-1H-indol-3-yl)-3-(3,4-dihydro-1H-isoquinolin-2-yl)piperidin-1-yl]pentanal Traditional Name: 5-[4-(4-chloro-1H-indol-3-yl)-3-(3,4-dihydro-1H-isoquinolin-2-yl)piperidino]valeraldehyde Formula: C27H32ClN3O MolecularWeight: 450.01548

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(C1C2=CNC3=C2C(=CC=C3)Cl)N4CCC5=CC=CC=C5C4)CCCCC=O

Isomeric SMILES

C1CN(CC(C1C2=CNC3=C2C(=CC=C3)Cl)N4CCC5=CC=CC=C5C4)CCCCC=O

InChI

InChI=1S/C27H32ClN3O/c28-24-9-6-10-25-27(24)23(17-29-25)22-12-14-30(13-4-1-5-16-32)19-26(22)31-15-11-20-7-2-3-8-21(20)18-31/h2-3,6-10,16-17,22,26,29H,1,4-5,11-15,18-19H2