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

Systemtic Name: 7-bromanyl-4-[2-(1H-indol-3-yl)ethyl]-9-methoxy-3-oxidanylidene-2-propan-2-yl-5H-1,4-benzoxazepine-5-carboxylic acid Openeye Name: 7-bromo-4-[2-(1H-indol-3-yl)ethyl]-2-isopropyl-9-methoxy-3-oxo-5H-1,4-benzoxazepine-5-carboxylic acid CAS Name: 7-bromo-4-[2-(1H-indol-3-yl)ethyl]-9-methoxy-3-oxo-2-propan-2-yl-5H-1,4-benzoxazepine-5-carboxylic acid IUPAC Name: 7-bromo-4-[2-(1H-indol-3-yl)ethyl]-9-methoxy-3-oxo-2-propan-2-yl-5H-1,4-benzoxazepine-5-carboxylic acid Traditional Name: 7-bromo-4-[2-(1H-indol-3-yl)ethyl]-2-isopropyl-3-keto-9-methoxy-5H-1,4-benzoxazepine-5-carboxylic acid Formula: C24H25BrN2O5 MolecularWeight: 501.3697

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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=CC=CC=C43

Isomeric SMILES

CC(C)C1C(=O)N(C(C2=CC(=CC(=C2O1)OC)Br)C(=O)O)CCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C24H25BrN2O5/c1-13(2)21-23(28)27(9-8-14-12-26-18-7-5-4-6-16(14)18)20(24(29)30)17-10-15(25)11-19(31-3)22(17)32-21/h4-7,10-13,20-21,26H,8-9H2,1-3H3,(H,29,30)