4-chloranyl-N-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]-3-nitro-benzamide CAS Name: 4-chloro-N-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]-3-nitro-benzamide Formula: C18H17ClN2O5 MolecularWeight: 376.79098

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C[C@@H](O2)C)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H17ClN2O5/c1-3-25-17-8-12-6-10(2)26-16(12)9-14(17)20-18(22)11-4-5-13(19)15(7-11)21(23)24/h4-5,7-10H,3,6H2,1-2H3,(H,20,22)/t10-/m0/s1