N-[(6E,10E)-2,6,10-trimethyl-12-[1,3,10-tris(oxidanyl)-6-oxidanylidene-11H-benzo[b][1,4]benzodiazepin-5-yl]dodeca-6,10-dien-2-yl]ethanamide

Systemtic Name: N-[(6E,10E)-2,6,10-trimethyl-12-[1,3,10-tris(oxidanyl)-6-oxidanylidene-11H-benzo[b][1,4]benzodiazepin-5-yl]dodeca-6,10-dien-2-yl]ethanamide Openeye Name: N-[(5E,9E)-1,1,5,9-tetramethyl-11-(1,3,10-trihydroxy-6-oxo-11H-benzo[b][1,4]benzodiazepin-5-yl)undeca-5,9-dienyl]acetamide CAS Name: N-[(6E,10E)-2,6,10-trimethyl-12-(1,3,10-trihydroxy-6-oxo-11H-benzo[b][1,4]benzodiazepin-5-yl)dodeca-6,10-dien-2-yl]acetamide IUPAC Name: N-[(6E,10E)-2,6,10-trimethyl-12-(1,3,10-trihydroxy-6-oxo-11H-benzo[b][1,4]benzodiazepin-5-yl)dodeca-6,10-dien-2-yl]acetamide Traditional Name: N-[(5E,9E)-1,1,5,9-tetramethyl-11-(1,3,10-trihydroxy-6-keto-11H-benzo[b][1,4]benzodiazepin-5-yl)undeca-5,9-dienyl]acetamide Formula: C30H39N3O5 MolecularWeight: 521.64776

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CCN1C2=CC(=CC(=C2NC3=C(C1=O)C=CC=C3O)O)O)C)CCCC(C)(C)NC(=O)C

Isomeric SMILES

C/C(=C\CC/C(=C/CN1C2=CC(=CC(=C2NC3=C(C1=O)C=CC=C3O)O)O)/C)/CCCC(C)(C)NC(=O)C

InChI

InChI=1S/C30H39N3O5/c1-19(11-8-15-30(4,5)32-21(3)34)9-6-10-20(2)14-16-33-24-17-22(35)18-26(37)28(24)31-27-23(29(33)38)12-7-13-25(27)36/h7,9,12-14,17-18,31,35-37H,6,8,10-11,15-16H2,1-5H3,(H,32,34)/b19-9+,20-14+