4-[[(1R,2S)-2-methylcyclohexyl]amino]-3-nitro-chromen-2-one

Systemtic Name: 4-[[(1R,2S)-2-methylcyclohexyl]amino]-3-nitro-chromen-2-one Openeye Name: 4-[[(1R,2S)-2-methylcyclohexyl]amino]-3-nitro-chromen-2-one CAS Name: 4-[[(1R,2S)-2-methylcyclohexyl]amino]-3-nitro-1-benzopyran-2-one IUPAC Name: 4-[[(1R,2S)-2-methylcyclohexyl]amino]-3-nitrochromen-2-one Traditional Name: 4-[[(1R,2S)-2-methylcyclohexyl]amino]-3-nitro-coumarin Formula: C16H18N2O4 MolecularWeight: 302.32512

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC2=C(C(=O)OC3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CCCC[C@H]1NC2=C(C(=O)OC3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O4/c1-10-6-2-4-8-12(10)17-14-11-7-3-5-9-13(11)22-16(19)15(14)18(20)21/h3,5,7,9-10,12,17H,2,4,6,8H2,1H3/t10-,12+/m0/s1