2-[2-[(3-bromophenyl)-(6-methyl-2-oxidanyl-4-oxidanylidene-pyran-3-yl)methyl]-1H-indol-3-yl]ethyl 2-methoxybenzoate

Systemtic Name: 2-[2-[(3-bromophenyl)-(6-methyl-2-oxidanyl-4-oxidanylidene-pyran-3-yl)methyl]-1H-indol-3-yl]ethyl 2-methoxybenzoate Openeye Name: 2-[2-[(3-bromophenyl)-(2-hydroxy-6-methyl-4-oxo-pyran-3-yl)methyl]-1H-indol-3-yl]ethyl 2-methoxybenzoate CAS Name: 2-methoxybenzoic acid 2-[2-[(3-bromophenyl)-(2-hydroxy-6-methyl-4-oxo-3-pyranyl)methyl]-1H-indol-3-yl]ethyl ester IUPAC Name: 2-[2-[(3-bromophenyl)-(2-hydroxy-6-methyl-4-oxopyran-3-yl)methyl]-1H-indol-3-yl]ethyl 2-methoxybenzoate Traditional Name: 2-methoxybenzoic acid 2-[2-[(3-bromophenyl)-(2-hydroxy-4-keto-6-methyl-pyran-3-yl)methyl]-1H-indol-3-yl]ethyl ester Formula: C31H26BrNO6 MolecularWeight: 588.44524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(O1)O)C(C2=CC(=CC=C2)Br)C3=C(C4=CC=CC=C4N3)CCOC(=O)C5=CC=CC=C5OC

Isomeric SMILES

CC1=CC(=O)C(=C(O1)O)C(C2=CC(=CC=C2)Br)C3=C(C4=CC=CC=C4N3)CCOC(=O)C5=CC=CC=C5OC

InChI

InChI=1S/C31H26BrNO6/c1-18-16-25(34)28(31(36)39-18)27(19-8-7-9-20(32)17-19)29-22(21-10-3-5-12-24(21)33-29)14-15-38-30(35)23-11-4-6-13-26(23)37-2/h3-13,16-17,27,33,36H,14-15H2,1-2H3