1-cycloheptyl-4-[(4-methoxyphenyl)methyl]-3-(3-methoxy-4-propoxy-phenyl)piperazine-2,5-dione

Systemtic Name: 1-cycloheptyl-4-[(4-methoxyphenyl)methyl]-3-(3-methoxy-4-propoxy-phenyl)piperazine-2,5-dione Openeye Name: 1-cycloheptyl-4-[(4-methoxyphenyl)methyl]-3-(3-methoxy-4-propoxy-phenyl)piperazine-2,5-dione CAS Name: 1-cycloheptyl-4-[(4-methoxyphenyl)methyl]-3-(3-methoxy-4-propoxyphenyl)piperazine-2,5-dione IUPAC Name: 1-cycloheptyl-4-[(4-methoxyphenyl)methyl]-3-(3-methoxy-4-propoxyphenyl)piperazine-2,5-dione Traditional Name: 1-cycloheptyl-3-(3-methoxy-4-propoxy-phenyl)-4-p-anisyl-piperazine-2,5-quinone Formula: C29H38N2O5 MolecularWeight: 494.62242

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2C(=O)N(CC(=O)N2CC3=CC=C(C=C3)OC)C4CCCCCC4)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C2C(=O)N(CC(=O)N2CC3=CC=C(C=C3)OC)C4CCCCCC4)OC

InChI

InChI=1S/C29H38N2O5/c1-4-17-36-25-16-13-22(18-26(25)35-3)28-29(33)30(23-9-7-5-6-8-10-23)20-27(32)31(28)19-21-11-14-24(34-2)15-12-21/h11-16,18,23,28H,4-10,17,19-20H2,1-3H3