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

Systemtic Name: 1-cycloheptyl-3-(3-methoxy-4-propoxy-phenyl)-4-phenethyl-piperazine-2,5-dione Openeye Name: 1-cycloheptyl-3-(3-methoxy-4-propoxy-phenyl)-4-phenethyl-piperazine-2,5-dione CAS Name: 1-cycloheptyl-3-(3-methoxy-4-propoxyphenyl)-4-phenethylpiperazine-2,5-dione IUPAC Name: 1-cycloheptyl-3-(3-methoxy-4-propoxyphenyl)-4-phenethylpiperazine-2,5-dione Traditional Name: 1-cycloheptyl-3-(3-methoxy-4-propoxy-phenyl)-4-phenethyl-piperazine-2,5-quinone Formula: C29H38N2O4 MolecularWeight: 478.62302

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2C(=O)N(CC(=O)N2CCC3=CC=CC=C3)C4CCCCCC4)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C2C(=O)N(CC(=O)N2CCC3=CC=CC=C3)C4CCCCCC4)OC

InChI

InChI=1S/C29H38N2O4/c1-3-19-35-25-16-15-23(20-26(25)34-2)28-29(33)31(24-13-9-4-5-10-14-24)21-27(32)30(28)18-17-22-11-7-6-8-12-22/h6-8,11-12,15-16,20,24,28H,3-5,9-10,13-14,17-19,21H2,1-2H3