(2E)-4-(4-hydroxyphenyl)-2-[[3-pentoxy-4-(pentylamino)phenyl]methylidene]butanamide

Systemtic Name: (2E)-4-(4-hydroxyphenyl)-2-[[3-pentoxy-4-(pentylamino)phenyl]methylidene]butanamide Openeye Name: (2E)-4-(4-hydroxyphenyl)-2-[[3-pentoxy-4-(pentylamino)phenyl]methylene]butanamide CAS Name: (2E)-4-(4-hydroxyphenyl)-2-[[3-pentoxy-4-(pentylamino)phenyl]methylidene]butanamide IUPAC Name: (2E)-4-(4-hydroxyphenyl)-2-[[3-pentoxy-4-(pentylamino)phenyl]methylidene]butanamide Traditional Name: (E)-3-[3-amoxy-4-(amylamino)phenyl]-2-[2-(4-hydroxyphenyl)ethyl]acrylamide Formula: C27H38N2O3 MolecularWeight: 438.60222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC1=C(C=C(C=C1)C=C(CCC2=CC=C(C=C2)O)C(=O)N)OCCCCC

Isomeric SMILES

CCCCCNC1=C(C=C(C=C1)/C=C(\CCC2=CC=C(C=C2)O)/C(=O)N)OCCCCC

InChI

InChI=1S/C27H38N2O3/c1-3-5-7-17-29-25-16-12-22(20-26(25)32-18-8-6-4-2)19-23(27(28)31)13-9-21-10-14-24(30)15-11-21/h10-12,14-16,19-20,29-30H,3-9,13,17-18H2,1-2H3,(H2,28,31)/b23-19+