1-[7-(3,4-dihydro-1H-isoquinolin-2-yl)-2,3-dimethyl-pyrrolo[3,2-b]pyridin-1-yl]propan-2-one

Systemtic Name: 1-[7-(3,4-dihydro-1H-isoquinolin-2-yl)-2,3-dimethyl-pyrrolo[3,2-b]pyridin-1-yl]propan-2-one Openeye Name: 1-[7-(3,4-dihydro-1H-isoquinolin-2-yl)-2,3-dimethyl-pyrrolo[3,2-b]pyridin-1-yl]propan-2-one CAS Name: 1-[7-(3,4-dihydro-1H-isoquinolin-2-yl)-2,3-dimethyl-1-pyrrolo[3,2-b]pyridinyl]-2-propanone IUPAC Name: 1-[7-(3,4-dihydro-1H-isoquinolin-2-yl)-2,3-dimethylpyrrolo[3,2-b]pyridin-1-yl]propan-2-one Traditional Name: 1-[7-(3,4-dihydro-1H-isoquinolin-2-yl)-2,3-dimethyl-pyrrolo[3,2-b]pyridin-1-yl]acetone Formula: C21H23N3O MolecularWeight: 333.42682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C(C=CN=C12)N3CCC4=CC=CC=C4C3)CC(=O)C)C

Isomeric SMILES

CC1=C(N(C2=C(C=CN=C12)N3CCC4=CC=CC=C4C3)CC(=O)C)C

InChI

InChI=1S/C21H23N3O/c1-14(25)12-24-16(3)15(2)20-21(24)19(8-10-22-20)23-11-9-17-6-4-5-7-18(17)13-23/h4-8,10H,9,11-13H2,1-3H3