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

Systemtic Name: 2-[2-methyl-3-(phenylmethyl)-1-propyl-pyrrolo[3,2-c]pyridin-4-yl]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-(3-benzyl-2-methyl-1-propyl-pyrrolo[3,2-c]pyridin-4-yl)-3,4-dihydro-1H-isoquinoline CAS Name: 2-[2-methyl-3-(phenylmethyl)-1-propyl-4-pyrrolo[3,2-c]pyridinyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-(3-benzyl-2-methyl-1-propylpyrrolo[3,2-c]pyridin-4-yl)-3,4-dihydro-1H-isoquinoline Traditional Name: 2-(3-benzyl-2-methyl-1-propyl-pyrrolo[3,2-c]pyridin-4-yl)-3,4-dihydro-1H-isoquinoline Formula: C27H29N3 MolecularWeight: 395.53926

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C2=C1C=CN=C2N3CCC4=CC=CC=C4C3)CC5=CC=CC=C5)C

Isomeric SMILES

CCCN1C(=C(C2=C1C=CN=C2N3CCC4=CC=CC=C4C3)CC5=CC=CC=C5)C

InChI

InChI=1S/C27H29N3/c1-3-16-30-20(2)24(18-21-9-5-4-6-10-21)26-25(30)13-15-28-27(26)29-17-14-22-11-7-8-12-23(22)19-29/h4-13,15H,3,14,16-19H2,1-2H3