N-[(E)-(4-chloranyl-3-nitro-phenyl)methylideneamino]-3-methoxy-4-(3-methylbutoxy)benzamide

Systemtic Name: N-[(E)-(4-chloranyl-3-nitro-phenyl)methylideneamino]-3-methoxy-4-(3-methylbutoxy)benzamide Openeye Name: N-[(E)-(4-chloro-3-nitro-phenyl)methyleneamino]-4-isopentyloxy-3-methoxy-benzamide CAS Name: N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]-3-methoxy-4-(3-methylbutoxy)benzamide IUPAC Name: N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]-3-methoxy-4-(3-methylbutoxy)benzamide Traditional Name: N-[(E)-(4-chloro-3-nitro-benzylidene)amino]-4-isoamoxy-3-methoxy-benzamide Formula: C20H22ClN3O5 MolecularWeight: 419.85878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C(=O)NN=CC2=CC(=C(C=C2)Cl)[N+](=O)[O-])OC

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)C(=O)N/N=C/C2=CC(=C(C=C2)Cl)[N+](=O)[O-])OC

InChI

InChI=1S/C20H22ClN3O5/c1-13(2)8-9-29-18-7-5-15(11-19(18)28-3)20(25)23-22-12-14-4-6-16(21)17(10-14)24(26)27/h4-7,10-13H,8-9H2,1-3H3,(H,23,25)/b22-12+