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4-phenyl-2-[3-(propan-2-ylamino)propyl]isoquinolin-1-one hydrobromide

4-phenyl-2-[3-(propan-2-ylamino)propyl]isoquinolin-1-one hydrobromide

Systemtic Name:4-phenyl-2-[3-(propan-2-ylamino)propyl]isoquinolin-1-one hydrobromide
Openeye Name:2-[3-(isopropylamino)propyl]-4-phenyl-isoquinolin-1-one hydrobromide
CAS Name:4-phenyl-2-[3-(propan-2-ylamino)propyl]-1-isoquinolinone hydrobromide
IUPAC Name:4-phenyl-2-[3-(propan-2-ylamino)propyl]isoquinolin-1-one hydrobromide
Traditional Name:2-[3-(isopropylamino)propyl]-4-phenyl-isocarbostyril hydrobromide
Formula: C21H25BrN2O
MolecularWeight: 401.34
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCCCN1C=C(C2=CC=CC=C2C1=O)C3=CC=CC=C3.Br


Isomeric SMILES

CC(C)NCCCN1C=C(C2=CC=CC=C2C1=O)C3=CC=CC=C3.Br


InChI

InChI=1S/C21H24N2O.BrH/c1-16(2)22-13-8-14-23-15-20(17-9-4-3-5-10-17)18-11-6-7-12-19(18)21(23)24;/h3-7,9-12,15-16,22H,8,13-14H2,1-2H3;1H


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