N-[(E)-[4-[(4-chlorophenyl)methoxy]-3-ethoxy-5-prop-2-enyl-phenyl]methylideneamino]-5-nitro-1-benzofuran-2-carboxamide

Systemtic Name: N-[(E)-[4-[(4-chlorophenyl)methoxy]-3-ethoxy-5-prop-2-enyl-phenyl]methylideneamino]-5-nitro-1-benzofuran-2-carboxamide Openeye Name: N-[(E)-[3-allyl-4-[(4-chlorophenyl)methoxy]-5-ethoxy-phenyl]methyleneamino]-5-nitro-benzofuran-2-carboxamide CAS Name: N-[(E)-[4-[(4-chlorophenyl)methoxy]-3-ethoxy-5-prop-2-enylphenyl]methylideneamino]-5-nitro-2-benzofurancarboxamide IUPAC Name: N-[(E)-[4-[(4-chlorophenyl)methoxy]-3-ethoxy-5-prop-2-enylphenyl]methylideneamino]-5-nitro-1-benzofuran-2-carboxamide Traditional Name: N-[(E)-[3-allyl-4-(4-chlorobenzyl)oxy-5-ethoxy-benzylidene]amino]-5-nitro-coumarilamide Formula: C28H24ClN3O6 MolecularWeight: 533.95966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC2=CC=C(C=C2)Cl)CC=C)C=NNC(=O)C3=CC4=C(O3)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC2=CC=C(C=C2)Cl)CC=C)/C=N/NC(=O)C3=CC4=C(O3)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C28H24ClN3O6/c1-3-5-20-12-19(13-25(36-4-2)27(20)37-17-18-6-8-22(29)9-7-18)16-30-31-28(33)26-15-21-14-23(32(34)35)10-11-24(21)38-26/h3,6-16H,1,4-5,17H2,2H3,(H,31,33)/b30-16+