7-azanyl-3-[[4-(2-bromanylethanoylamino)phenoxy]-ethanoyl-amino]-5-methanoyl-5-oxidanyl-4-oxidanylidene-7-phenyl-heptanamide

Systemtic Name: 7-azanyl-3-[[4-(2-bromanylethanoylamino)phenoxy]-ethanoyl-amino]-5-methanoyl-5-oxidanyl-4-oxidanylidene-7-phenyl-heptanamide Openeye Name: 3-[acetyl-[4-[(2-bromoacetyl)amino]phenoxy]amino]-7-amino-5-formyl-5-hydroxy-4-oxo-7-phenyl-heptanamide CAS Name: 3-[acetyl-[4-[(2-bromo-1-oxoethyl)amino]phenoxy]amino]-7-amino-5-formyl-5-hydroxy-4-oxo-7-phenylheptanamide IUPAC Name: 3-[acetyl-[4-[(2-bromoacetyl)amino]phenoxy]amino]-7-amino-5-formyl-5-hydroxy-4-oxo-7-phenylheptanamide Traditional Name: 3-[acetyl-[4-[(2-bromoacetyl)amino]phenoxy]amino]-7-amino-5-formyl-5-hydroxy-4-keto-7-phenyl-enanthamide Formula: C24H27BrN4O7 MolecularWeight: 563.39778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C(CC(=O)N)C(=O)C(CC(C1=CC=CC=C1)N)(C=O)O)OC2=CC=C(C=C2)NC(=O)CBr

Isomeric SMILES

CC(=O)N(C(CC(=O)N)C(=O)C(CC(C1=CC=CC=C1)N)(C=O)O)OC2=CC=C(C=C2)NC(=O)CBr

InChI

InChI=1S/C24H27BrN4O7/c1-15(31)29(36-18-9-7-17(8-10-18)28-22(33)13-25)20(11-21(27)32)23(34)24(35,14-30)12-19(26)16-5-3-2-4-6-16/h2-10,14,19-20,35H,11-13,26H2,1H3,(H2,27,32)(H,28,33)