methyl 4-[2-[4-(2-azanyl-3-cyano-4H-benzo[h]chromen-4-yl)-2-methoxy-phenoxy]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[4-(2-azanyl-3-cyano-4H-benzo[h]chromen-4-yl)-2-methoxy-phenoxy]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[4-(2-amino-3-cyano-4H-benzo[h]chromen-4-yl)-2-methoxy-phenoxy]acetyl]amino]benzoate CAS Name: 4-[[2-[4-(2-amino-3-cyano-4H-benzo[h][1]benzopyran-4-yl)-2-methoxyphenoxy]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[4-(2-amino-3-cyano-4H-benzo[h]chromen-4-yl)-2-methoxyphenoxy]acetyl]amino]benzoate Traditional Name: 4-[[2-[4-(2-amino-3-cyano-4H-benzo[h]chromen-4-yl)-2-methoxy-phenoxy]acetyl]amino]benzoic acid methyl ester Formula: C31H25N3O6 MolecularWeight: 535.5467

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2C3=C(C4=CC=CC=C4C=C3)OC(=C2C#N)N)OCC(=O)NC5=CC=C(C=C5)C(=O)OC

Isomeric SMILES

COC1=C(C=CC(=C1)C2C3=C(C4=CC=CC=C4C=C3)OC(=C2C#N)N)OCC(=O)NC5=CC=C(C=C5)C(=O)OC

InChI

InChI=1S/C31H25N3O6/c1-37-26-15-20(10-14-25(26)39-17-27(35)34-21-11-7-19(8-12-21)31(36)38-2)28-23-13-9-18-5-3-4-6-22(18)29(23)40-30(33)24(28)16-32/h3-15,28H,17,33H2,1-2H3,(H,34,35)