methyl 2-[4-(2-azanyl-3-cyano-4H-benzo[h]chromen-4-yl)-5-bromanyl-2-methoxy-phenoxy]ethanoate

Systemtic Name: methyl 2-[4-(2-azanyl-3-cyano-4H-benzo[h]chromen-4-yl)-5-bromanyl-2-methoxy-phenoxy]ethanoate Openeye Name: methyl 2-[4-(2-amino-3-cyano-4H-benzo[h]chromen-4-yl)-5-bromo-2-methoxy-phenoxy]acetate CAS Name: 2-[4-(2-amino-3-cyano-4H-benzo[h][1]benzopyran-4-yl)-5-bromo-2-methoxyphenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[4-(2-amino-3-cyano-4H-benzo[h]chromen-4-yl)-5-bromo-2-methoxyphenoxy]acetate Traditional Name: 2-[4-(2-amino-3-cyano-4H-benzo[h]chromen-4-yl)-5-bromo-2-methoxy-phenoxy]acetic acid methyl ester Formula: C24H19BrN2O5 MolecularWeight: 495.32206

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C2C3=C(C4=CC=CC=C4C=C3)OC(=C2C#N)N)Br)OCC(=O)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C2C3=C(C4=CC=CC=C4C=C3)OC(=C2C#N)N)Br)OCC(=O)OC

InChI

InChI=1S/C24H19BrN2O5/c1-29-19-9-16(18(25)10-20(19)31-12-21(28)30-2)22-15-8-7-13-5-3-4-6-14(13)23(15)32-24(27)17(22)11-26/h3-10,22H,12,27H2,1-2H3