1-cycloheptyl-4-(furan-2-ylmethyl)-3-(3-methoxy-4-propoxy-phenyl)piperazine-2,5-dione

Systemtic Name: 1-cycloheptyl-4-(furan-2-ylmethyl)-3-(3-methoxy-4-propoxy-phenyl)piperazine-2,5-dione Openeye Name: 1-cycloheptyl-4-(2-furylmethyl)-3-(3-methoxy-4-propoxy-phenyl)piperazine-2,5-dione CAS Name: 1-cycloheptyl-4-(2-furanylmethyl)-3-(3-methoxy-4-propoxyphenyl)piperazine-2,5-dione IUPAC Name: 1-cycloheptyl-4-(furan-2-ylmethyl)-3-(3-methoxy-4-propoxyphenyl)piperazine-2,5-dione Traditional Name: 1-cycloheptyl-4-(2-furfuryl)-3-(3-methoxy-4-propoxy-phenyl)piperazine-2,5-quinone Formula: C26H34N2O5 MolecularWeight: 454.55856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2C(=O)N(CC(=O)N2CC3=CC=CO3)C4CCCCCC4)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C2C(=O)N(CC(=O)N2CC3=CC=CO3)C4CCCCCC4)OC

InChI

InChI=1S/C26H34N2O5/c1-3-14-33-22-13-12-19(16-23(22)31-2)25-26(30)27(20-9-6-4-5-7-10-20)18-24(29)28(25)17-21-11-8-15-32-21/h8,11-13,15-16,20,25H,3-7,9-10,14,17-18H2,1-2H3