N-(5-azanylpentyl)-2-[2-(4-phenylphenyl)ethanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-(5-azanylpentyl)-2-[2-(4-phenylphenyl)ethanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: N-(5-aminopentyl)-2-[2-(4-phenylphenyl)acetyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: N-(5-aminopentyl)-2-[1-oxo-2-(4-phenylphenyl)ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: N-(5-aminopentyl)-2-[2-(4-phenylphenyl)acetyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: N-(5-aminopentyl)-2-[2-(4-phenylphenyl)acetyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C29H33N3O2 MolecularWeight: 455.59122

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=CC=CC=C21)C(=O)CC3=CC=C(C=C3)C4=CC=CC=C4)C(=O)NCCCCCN

Isomeric SMILES

C1C(N(CC2=CC=CC=C21)C(=O)CC3=CC=C(C=C3)C4=CC=CC=C4)C(=O)NCCCCCN

InChI

InChI=1S/C29H33N3O2/c30-17-7-2-8-18-31-29(34)27-20-25-11-5-6-12-26(25)21-32(27)28(33)19-22-13-15-24(16-14-22)23-9-3-1-4-10-23/h1,3-6,9-16,27H,2,7-8,17-21,30H2,(H,31,34)