4-[2-hydroxyethyl-(phenylmethyl)amino]-3-nitro-chromen-2-one

Systemtic Name: 4-[2-hydroxyethyl-(phenylmethyl)amino]-3-nitro-chromen-2-one Openeye Name: 4-[benzyl(2-hydroxyethyl)amino]-3-nitro-chromen-2-one CAS Name: 4-[2-hydroxyethyl-(phenylmethyl)amino]-3-nitro-1-benzopyran-2-one IUPAC Name: 4-[benzyl(2-hydroxyethyl)amino]-3-nitrochromen-2-one Traditional Name: 4-[benzyl(2-hydroxyethyl)amino]-3-nitro-coumarin Formula: C18H16N2O5 MolecularWeight: 340.33004

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCO)C2=C(C(=O)OC3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN(CCO)C2=C(C(=O)OC3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C18H16N2O5/c21-11-10-19(12-13-6-2-1-3-7-13)16-14-8-4-5-9-15(14)25-18(22)17(16)20(23)24/h1-9,21H,10-12H2