methyl 4-[7-bromanyl-3,9-bis(oxidanylidene)-2-phenethyl-1H-chromeno[2,3-c]pyrrol-1-yl]benzoate

Systemtic Name: methyl 4-[7-bromanyl-3,9-bis(oxidanylidene)-2-phenethyl-1H-chromeno[2,3-c]pyrrol-1-yl]benzoate Openeye Name: methyl 4-(7-bromo-3,9-dioxo-2-phenethyl-1H-chromeno[2,3-c]pyrrol-1-yl)benzoate CAS Name: 4-(7-bromo-3,9-dioxo-2-phenethyl-1H-[1]benzopyrano[2,3-c]pyrrol-1-yl)benzoic acid methyl ester IUPAC Name: methyl 4-(7-bromo-3,9-dioxo-2-phenethyl-1H-chromeno[2,3-c]pyrrol-1-yl)benzoate Traditional Name: 4-(7-bromo-3,9-diketo-2-phenethyl-1H-chromeno[2,3-c]pyrrol-1-yl)benzoic acid methyl ester Formula: C27H20BrNO5 MolecularWeight: 518.3554

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2C3=C(C(=O)N2CCC4=CC=CC=C4)OC5=C(C3=O)C=C(C=C5)Br

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2C3=C(C(=O)N2CCC4=CC=CC=C4)OC5=C(C3=O)C=C(C=C5)Br

InChI

InChI=1S/C27H20BrNO5/c1-33-27(32)18-9-7-17(8-10-18)23-22-24(30)20-15-19(28)11-12-21(20)34-25(22)26(31)29(23)14-13-16-5-3-2-4-6-16/h2-12,15,23H,13-14H2,1H3