(phenylmethyl) N-[3-(4-methoxyphenyl)-1-oxidanylidene-1-[(phenylmethyl)amino]non-8-en-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[3-(4-methoxyphenyl)-1-oxidanylidene-1-[(phenylmethyl)amino]non-8-en-2-yl]carbamate Openeye Name: benzyl N-[1-(benzylcarbamoyl)-2-(4-methoxyphenyl)oct-7-enyl]carbamate CAS Name: N-[3-(4-methoxyphenyl)-1-oxo-1-[(phenylmethyl)amino]non-8-en-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-(benzylamino)-3-(4-methoxyphenyl)-1-oxonon-8-en-2-yl]carbamate Traditional Name: N-[1-(benzylcarbamoyl)-2-(4-methoxyphenyl)oct-7-enyl]carbamic acid benzyl ester Formula: C31H36N2O4 MolecularWeight: 500.62854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CCCCC=C)C(C(=O)NCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C(CCCCC=C)C(C(=O)NCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C31H36N2O4/c1-3-4-5-12-17-28(26-18-20-27(36-2)21-19-26)29(30(34)32-22-24-13-8-6-9-14-24)33-31(35)37-23-25-15-10-7-11-16-25/h3,6-11,13-16,18-21,28-29H,1,4-5,12,17,22-23H2,2H3,(H,32,34)(H,33,35)