ethyl 3-[(2S)-2-(3-nitrophenyl)-2,3-dihydro-1,3-benzoxazol-5-yl]propanoate

Systemtic Name: ethyl 3-[(2S)-2-(3-nitrophenyl)-2,3-dihydro-1,3-benzoxazol-5-yl]propanoate Openeye Name: ethyl 3-[(2S)-2-(3-nitrophenyl)-2,3-dihydro-1,3-benzoxazol-5-yl]propanoate CAS Name: 3-[(2S)-2-(3-nitrophenyl)-2,3-dihydro-1,3-benzoxazol-5-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[(2S)-2-(3-nitrophenyl)-2,3-dihydro-1,3-benzoxazol-5-yl]propanoate Traditional Name: 3-[(2S)-2-(3-nitrophenyl)-2,3-dihydro-1,3-benzoxazol-5-yl]propionic acid ethyl ester Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=CC2=C(C=C1)OC(N2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CCC1=CC2=C(C=C1)O[C@H](N2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O5/c1-2-24-17(21)9-7-12-6-8-16-15(10-12)19-18(25-16)13-4-3-5-14(11-13)20(22)23/h3-6,8,10-11,18-19H,2,7,9H2,1H3/t18-/m0/s1