7-bromanyl-9-methoxy-4-[2-(5-methoxy-1H-indol-3-yl)ethyl]-3-oxidanylidene-2-propan-2-yl-5H-1,4-benzoxazepine-5-carboxylic acid

Systemtic Name: 7-bromanyl-9-methoxy-4-[2-(5-methoxy-1H-indol-3-yl)ethyl]-3-oxidanylidene-2-propan-2-yl-5H-1,4-benzoxazepine-5-carboxylic acid Openeye Name: 7-bromo-2-isopropyl-9-methoxy-4-[2-(5-methoxy-1H-indol-3-yl)ethyl]-3-oxo-5H-1,4-benzoxazepine-5-carboxylic acid CAS Name: 7-bromo-9-methoxy-4-[2-(5-methoxy-1H-indol-3-yl)ethyl]-3-oxo-2-propan-2-yl-5H-1,4-benzoxazepine-5-carboxylic acid IUPAC Name: 7-bromo-9-methoxy-4-[2-(5-methoxy-1H-indol-3-yl)ethyl]-3-oxo-2-propan-2-yl-5H-1,4-benzoxazepine-5-carboxylic acid Traditional Name: 7-bromo-2-isopropyl-3-keto-9-methoxy-4-[2-(5-methoxy-1H-indol-3-yl)ethyl]-5H-1,4-benzoxazepine-5-carboxylic acid Formula: C25H27BrN2O6 MolecularWeight: 531.39568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=O)N(C(C2=CC(=CC(=C2O1)OC)Br)C(=O)O)CCC3=CNC4=C3C=C(C=C4)OC

Isomeric SMILES

CC(C)C1C(=O)N(C(C2=CC(=CC(=C2O1)OC)Br)C(=O)O)CCC3=CNC4=C3C=C(C=C4)OC

InChI

InChI=1S/C25H27BrN2O6/c1-13(2)22-24(29)28(8-7-14-12-27-19-6-5-16(32-3)11-17(14)19)21(25(30)31)18-9-15(26)10-20(33-4)23(18)34-22/h5-6,9-13,21-22,27H,7-8H2,1-4H3,(H,30,31)