4-[[(2-methoxy-5-nitro-phenyl)amino]methyl]-7-methyl-6-propan-2-yl-chromen-2-one

Systemtic Name: 4-[[(2-methoxy-5-nitro-phenyl)amino]methyl]-7-methyl-6-propan-2-yl-chromen-2-one Openeye Name: 6-isopropyl-4-[(2-methoxy-5-nitro-anilino)methyl]-7-methyl-chromen-2-one CAS Name: 4-[(2-methoxy-5-nitroanilino)methyl]-7-methyl-6-propan-2-yl-1-benzopyran-2-one IUPAC Name: 4-[(2-methoxy-5-nitroanilino)methyl]-7-methyl-6-propan-2-ylchromen-2-one Traditional Name: 6-isopropyl-4-[(2-methoxy-5-nitro-anilino)methyl]-7-methyl-coumarin Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CNC3=C(C=CC(=C3)[N+](=O)[O-])OC)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CNC3=C(C=CC(=C3)[N+](=O)[O-])OC)C(C)C

InChI

InChI=1S/C21H22N2O5/c1-12(2)16-10-17-14(8-21(24)28-20(17)7-13(16)3)11-22-18-9-15(23(25)26)5-6-19(18)27-4/h5-10,12,22H,11H2,1-4H3