N'-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxidanylidene-3-(4-phenylmethoxyphenyl)propan-2-yl]-2-methyl-pentanediamide

Systemtic Name: N'-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxidanylidene-3-(4-phenylmethoxyphenyl)propan-2-yl]-2-methyl-pentanediamide Openeye Name: N'-[1-[(4-benzyloxyphenyl)methyl]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-2-methyl-pentanediamide CAS Name: N'-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxo-3-(4-phenylmethoxyphenyl)propan-2-yl]-2-methylpentanediamide IUPAC Name: N'-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxo-3-(4-phenylmethoxyphenyl)propan-2-yl]-2-methylpentanediamide Traditional Name: N'-[1-(4-benzoxybenzyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]-2-methyl-glutaramide Formula: C31H35N3O4 MolecularWeight: 513.6273

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)NC(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)N3CCC4=CC=CC=C4C3)C(=O)N

Isomeric SMILES

CC(CCC(=O)NC(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)N3CCC4=CC=CC=C4C3)C(=O)N

InChI

InChI=1S/C31H35N3O4/c1-22(30(32)36)11-16-29(35)33-28(31(37)34-18-17-25-9-5-6-10-26(25)20-34)19-23-12-14-27(15-13-23)38-21-24-7-3-2-4-8-24/h2-10,12-15,22,28H,11,16-21H2,1H3,(H2,32,36)(H,33,35)