3-nitro-4-[[(1S)-1-phenylethyl]amino]chromen-2-one

Systemtic Name: 3-nitro-4-[[(1S)-1-phenylethyl]amino]chromen-2-one Openeye Name: 3-nitro-4-[[(1S)-1-phenylethyl]amino]chromen-2-one CAS Name: 3-nitro-4-[[(1S)-1-phenylethyl]amino]-1-benzopyran-2-one IUPAC Name: 3-nitro-4-[[(1S)-1-phenylethyl]amino]chromen-2-one Traditional Name: 3-nitro-4-[[(1S)-1-phenylethyl]amino]coumarin Formula: C17H14N2O4 MolecularWeight: 310.30406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=C(C(=O)OC3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NC2=C(C(=O)OC3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C17H14N2O4/c1-11(12-7-3-2-4-8-12)18-15-13-9-5-6-10-14(13)23-17(20)16(15)19(21)22/h2-11,18H,1H3/t11-/m0/s1