N-[1-(3-cyanophenyl)-2-(hydroxymethyl)-4-methyl-hexan-3-yl]-4-(3-ethylphenyl)benzamide

Systemtic Name: N-[1-(3-cyanophenyl)-2-(hydroxymethyl)-4-methyl-hexan-3-yl]-4-(3-ethylphenyl)benzamide Openeye Name: N-[1-[1-[(3-cyanophenyl)methyl]-2-hydroxy-ethyl]-2-methyl-butyl]-4-(3-ethylphenyl)benzamide CAS Name: N-[1-(3-cyanophenyl)-2-(hydroxymethyl)-4-methylhexan-3-yl]-4-(3-ethylphenyl)benzamide IUPAC Name: N-[1-(3-cyanophenyl)-2-(hydroxymethyl)-4-methylhexan-3-yl]-4-(3-ethylphenyl)benzamide Traditional Name: N-[1-[1-(3-cyanobenzyl)-2-hydroxy-ethyl]-2-methyl-butyl]-4-(3-ethylphenyl)benzamide Formula: C30H34N2O2 MolecularWeight: 454.60316

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1)C2=CC=C(C=C2)C(=O)NC(C(C)CC)C(CC3=CC=CC(=C3)C#N)CO

Isomeric SMILES

CCC1=CC=CC(=C1)C2=CC=C(C=C2)C(=O)NC(C(C)CC)C(CC3=CC=CC(=C3)C#N)CO

InChI

InChI=1S/C30H34N2O2/c1-4-21(3)29(28(20-33)18-23-9-6-10-24(16-23)19-31)32-30(34)26-14-12-25(13-15-26)27-11-7-8-22(5-2)17-27/h6-17,21,28-29,33H,4-5,18,20H2,1-3H3,(H,32,34)