(4S,14S)-3,15-dimethyl-4,14-diphenyl-6,9,12-trioxa-3,15,21-triazabicyclo[15.3.1]henicosa-1(21),17,19-triene-2,16-dione

Systemtic Name: (4S,14S)-3,15-dimethyl-4,14-diphenyl-6,9,12-trioxa-3,15,21-triazabicyclo[15.3.1]henicosa-1(21),17,19-triene-2,16-dione Openeye Name: (4S,14S)-3,15-dimethyl-4,14-diphenyl-6,9,12-trioxa-3,15,21-triazabicyclo[15.3.1]henicosa-1(21),17,19-triene-2,16-dione CAS Name: (4S,14S)-3,15-dimethyl-4,14-diphenyl-6,9,12-trioxa-3,15,21-triazabicyclo[15.3.1]heneicosa-1(21),17,19-triene-2,16-dione IUPAC Name: (4S,14S)-3,15-dimethyl-4,14-diphenyl-6,9,12-trioxa-3,15,21-triazabicyclo[15.3.1]henicosa-1(21),17,19-triene-2,16-dione Traditional Name: (4S,14S)-3,15-dimethyl-4,14-diphenyl-6,9,12-trioxa-3,15,21-triazabicyclo[15.3.1]heneicosa-1(21),17,19-triene-2,16-quinone Formula: C29H33N3O5 MolecularWeight: 503.58942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(COCCOCCOCC(N(C(=O)C2=CC=CC(=N2)C1=O)C)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CN1[C@H](COCCOCCOC[C@@H](N(C(=O)C2=CC=CC(=N2)C1=O)C)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H33N3O5/c1-31-26(22-10-5-3-6-11-22)20-36-18-16-35-17-19-37-21-27(23-12-7-4-8-13-23)32(2)29(34)25-15-9-14-24(30-25)28(31)33/h3-15,26-27H,16-21H2,1-2H3/t26-,27-/m1/s1