N-[(E)-4-(hydroxymethyl)-5-(3-isocyanophenyl)-1-phenyl-pent-1-en-3-yl]-4-phenyl-benzamide

Systemtic Name: N-[(E)-4-(hydroxymethyl)-5-(3-isocyanophenyl)-1-phenyl-pent-1-en-3-yl]-4-phenyl-benzamide Openeye Name: N-[(E)-1-[1-(hydroxymethyl)-2-(3-isocyanophenyl)ethyl]-3-phenyl-allyl]-4-phenyl-benzamide CAS Name: N-[(E)-4-(hydroxymethyl)-5-(3-isocyanophenyl)-1-phenylpent-1-en-3-yl]-4-phenylbenzamide IUPAC Name: N-[(E)-4-(hydroxymethyl)-5-(3-isocyanophenyl)-1-phenylpent-1-en-3-yl]-4-phenylbenzamide Traditional Name: N-[(E)-1-[2-hydroxy-1-(3-isocyanobenzyl)ethyl]-3-phenyl-allyl]-4-phenyl-benzamide Formula: C32H28N2O2 MolecularWeight: 472.57692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=CC=CC(=C1)CC(CO)C(C=CC2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

[C-]#[N+]C1=CC=CC(=C1)CC(CO)C(/C=C/C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C32H28N2O2/c1-33-30-14-8-11-25(22-30)21-29(23-35)31(20-15-24-9-4-2-5-10-24)34-32(36)28-18-16-27(17-19-28)26-12-6-3-7-13-26/h2-20,22,29,31,35H,21,23H2,(H,34,36)/b20-15+