methyl 3-[[4-(cyclohexylamino)-2-oxidanylidene-chromen-3-yl]carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[[4-(cyclohexylamino)-2-oxidanylidene-chromen-3-yl]carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[[4-(cyclohexylamino)-2-oxo-chromen-3-yl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[[4-(cyclohexylamino)-2-oxo-1-benzopyran-3-yl]amino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[[4-(cyclohexylamino)-2-oxochromen-3-yl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[4-(cyclohexylamino)-2-keto-chromen-3-yl]carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C24H23N3O7 MolecularWeight: 465.45532

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)C(=O)NC2=C(C3=CC=CC=C3OC2=O)NC4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)C(=O)NC2=C(C3=CC=CC=C3OC2=O)NC4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C24H23N3O7/c1-33-23(29)15-11-14(12-17(13-15)27(31)32)22(28)26-21-20(25-16-7-3-2-4-8-16)18-9-5-6-10-19(18)34-24(21)30/h5-6,9-13,16,25H,2-4,7-8H2,1H3,(H,26,28)