(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 3-(6-nitroindazol-1-yl)propanoate

Systemtic Name: (7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 3-(6-nitroindazol-1-yl)propanoate Openeye Name: (6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl 3-(6-nitroindazol-1-yl)propanoate CAS Name: 3-(6-nitro-1-indazolyl)propanoic acid (7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methyl 3-(6-nitroindazol-1-yl)propanoate Traditional Name: 3-(6-nitroindazol-1-yl)propionic acid (6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C24H23N3O6 MolecularWeight: 449.45592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CCN3C4=C(C=CC(=C4)[N+](=O)[O-])C=N3)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CCN3C4=C(C=CC(=C4)[N+](=O)[O-])C=N3)C(C)C

InChI

InChI=1S/C24H23N3O6/c1-14(2)19-11-20-17(9-24(29)33-22(20)8-15(19)3)13-32-23(28)6-7-26-21-10-18(27(30)31)5-4-16(21)12-25-26/h4-5,8-12,14H,6-7,13H2,1-3H3