2-[2,3-dimethyl-1-(oxiran-2-ylmethyl)pyrrolo[3,2-b]pyridin-7-yl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[2,3-dimethyl-1-(oxiran-2-ylmethyl)pyrrolo[3,2-b]pyridin-7-yl]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[2,3-dimethyl-1-(oxiran-2-ylmethyl)pyrrolo[3,2-b]pyridin-7-yl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-[2,3-dimethyl-1-(2-oxiranylmethyl)-7-pyrrolo[3,2-b]pyridinyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[2,3-dimethyl-1-(oxiran-2-ylmethyl)pyrrolo[3,2-b]pyridin-7-yl]-3,4-dihydro-1H-isoquinoline Traditional Name: 2-(1-glycidyl-2,3-dimethyl-pyrrolo[3,2-b]pyridin-7-yl)-3,4-dihydro-1H-isoquinoline 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)CC5CO5)C

Isomeric SMILES

CC1=C(N(C2=C(C=CN=C12)N3CCC4=CC=CC=C4C3)CC5CO5)C

InChI

InChI=1S/C21H23N3O/c1-14-15(2)24(12-18-13-25-18)21-19(7-9-22-20(14)21)23-10-8-16-5-3-4-6-17(16)11-23/h3-7,9,18H,8,10-13H2,1-2H3