N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]-4-phenoxy-benzamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]-4-phenoxy-benzamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]-4-phenoxy-benzamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methyl-2-pyrrolyl)ethyl]-4-phenoxybenzamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]-4-phenoxybenzamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylpyrrol-2-yl)ethyl]-4-phenoxy-benzamide Formula: C29H29N3O2 MolecularWeight: 451.55946

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(CNC(=O)C2=CC=C(C=C2)OC3=CC=CC=C3)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CN1C=CC=C1C(CNC(=O)C2=CC=C(C=C2)OC3=CC=CC=C3)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C29H29N3O2/c1-31-18-7-12-27(31)28(32-19-17-22-8-5-6-9-24(22)21-32)20-30-29(33)23-13-15-26(16-14-23)34-25-10-3-2-4-11-25/h2-16,18,28H,17,19-21H2,1H3,(H,30,33)