3-(1-methylpyrrol-2-yl)-2-(phenylmethyl)-4-(piperazin-1-ylmethyl)-3,4-dihydro-1H-isoquinoline

Systemtic Name: 3-(1-methylpyrrol-2-yl)-2-(phenylmethyl)-4-(piperazin-1-ylmethyl)-3,4-dihydro-1H-isoquinoline Openeye Name: 2-benzyl-3-(1-methylpyrrol-2-yl)-4-(piperazin-1-ylmethyl)-3,4-dihydro-1H-isoquinoline CAS Name: 3-(1-methyl-2-pyrrolyl)-2-(phenylmethyl)-4-(1-piperazinylmethyl)-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-benzyl-3-(1-methylpyrrol-2-yl)-4-(piperazin-1-ylmethyl)-3,4-dihydro-1H-isoquinoline Traditional Name: 2-benzyl-3-(1-methylpyrrol-2-yl)-4-(piperazinomethyl)-3,4-dihydro-1H-isoquinoline Formula: C26H32N4 MolecularWeight: 400.55908

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2C(C3=CC=CC=C3CN2CC4=CC=CC=C4)CN5CCNCC5

Isomeric SMILES

CN1C=CC=C1C2C(C3=CC=CC=C3CN2CC4=CC=CC=C4)CN5CCNCC5

InChI

InChI=1S/C26H32N4/c1-28-15-7-12-25(28)26-24(20-29-16-13-27-14-17-29)23-11-6-5-10-22(23)19-30(26)18-21-8-3-2-4-9-21/h2-12,15,24,26-27H,13-14,16-20H2,1H3