4-hexyl-1-methyl-2-[[4-(3,4,5-trimethoxyphenyl)phenyl]methyl]-2H-1,4-diazepine-3,7-dione

Systemtic Name: 4-hexyl-1-methyl-2-[[4-(3,4,5-trimethoxyphenyl)phenyl]methyl]-2H-1,4-diazepine-3,7-dione Openeye Name: 4-hexyl-1-methyl-2-[[4-(3,4,5-trimethoxyphenyl)phenyl]methyl]-2H-1,4-diazepine-3,7-dione CAS Name: 4-hexyl-1-methyl-2-[[4-(3,4,5-trimethoxyphenyl)phenyl]methyl]-2H-1,4-diazepine-3,7-dione IUPAC Name: 4-hexyl-1-methyl-2-[[4-(3,4,5-trimethoxyphenyl)phenyl]methyl]-2H-1,4-diazepine-3,7-dione Traditional Name: 4-hexyl-1-methyl-2-[4-(3,4,5-trimethoxyphenyl)benzyl]-2H-1,4-diazepine-3,7-quinone Formula: C28H36N2O5 MolecularWeight: 480.59584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C=CC(=O)N(C(C1=O)CC2=CC=C(C=C2)C3=CC(=C(C(=C3)OC)OC)OC)C

Isomeric SMILES

CCCCCCN1C=CC(=O)N(C(C1=O)CC2=CC=C(C=C2)C3=CC(=C(C(=C3)OC)OC)OC)C

InChI

InChI=1S/C28H36N2O5/c1-6-7-8-9-15-30-16-14-26(31)29(2)23(28(30)32)17-20-10-12-21(13-11-20)22-18-24(33-3)27(35-5)25(19-22)34-4/h10-14,16,18-19,23H,6-9,15,17H2,1-5H3