4-[2-(1H-indol-3-yl)ethyl]-8-methoxy-3-oxidanylidene-2-propan-2-yl-5H-1,4-benzoxazepine-5-carboxylic acid

Systemtic Name: 4-[2-(1H-indol-3-yl)ethyl]-8-methoxy-3-oxidanylidene-2-propan-2-yl-5H-1,4-benzoxazepine-5-carboxylic acid Openeye Name: 4-[2-(1H-indol-3-yl)ethyl]-2-isopropyl-8-methoxy-3-oxo-5H-1,4-benzoxazepine-5-carboxylic acid CAS Name: 4-[2-(1H-indol-3-yl)ethyl]-8-methoxy-3-oxo-2-propan-2-yl-5H-1,4-benzoxazepine-5-carboxylic acid IUPAC Name: 4-[2-(1H-indol-3-yl)ethyl]-8-methoxy-3-oxo-2-propan-2-yl-5H-1,4-benzoxazepine-5-carboxylic acid Traditional Name: 4-[2-(1H-indol-3-yl)ethyl]-2-isopropyl-3-keto-8-methoxy-5H-1,4-benzoxazepine-5-carboxylic acid Formula: C24H26N2O5 MolecularWeight: 422.47364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=O)N(C(C2=C(O1)C=C(C=C2)OC)C(=O)O)CCC3=CNC4=CC=CC=C43

Isomeric SMILES

CC(C)C1C(=O)N(C(C2=C(O1)C=C(C=C2)OC)C(=O)O)CCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C24H26N2O5/c1-14(2)22-23(27)26(11-10-15-13-25-19-7-5-4-6-17(15)19)21(24(28)29)18-9-8-16(30-3)12-20(18)31-22/h4-9,12-14,21-22,25H,10-11H2,1-3H3,(H,28,29)