sodium 2-[2-methyl-3-(phenylmethyl)pyrrolo[3,2-c]pyridin-1-id-4-yl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: sodium 2-[2-methyl-3-(phenylmethyl)pyrrolo[3,2-c]pyridin-1-id-4-yl]-3,4-dihydro-1H-isoquinoline Openeye Name: sodium 2-(3-benzyl-2-methyl-pyrrolo[3,2-c]pyridin-1-id-4-yl)-3,4-dihydro-1H-isoquinoline CAS Name: sodium 2-[2-methyl-3-(phenylmethyl)-4-pyrrolo[3,2-c]pyridin-1-idyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: sodium 2-(3-benzyl-2-methylpyrrolo[3,2-c]pyridin-1-id-4-yl)-3,4-dihydro-1H-isoquinoline Traditional Name: sodium 2-(3-benzyl-2-methyl-pyrrolo[3,2-c]pyridin-1-id-4-yl)-3,4-dihydro-1H-isoquinoline Formula: C24H22N3Na MolecularWeight: 375.44135

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C([N-]1)C=CN=C2N3CCC4=CC=CC=C4C3)CC5=CC=CC=C5.[Na+]

Isomeric SMILES

CC1=C(C2=C([N-]1)C=CN=C2N3CCC4=CC=CC=C4C3)CC5=CC=CC=C5.[Na+]

InChI

InChI=1S/C24H22N3.Na/c1-17-21(15-18-7-3-2-4-8-18)23-22(26-17)11-13-25-24(23)27-14-12-19-9-5-6-10-20(19)16-27;/h2-11,13H,12,14-16H2,1H3;/q-1;+1