N-[2-[[(E)-(4-butoxyphenyl)methylideneamino]carbamoyl]phenyl]-2-chloranyl-4-nitro-benzamide

Systemtic Name: N-[2-[[(E)-(4-butoxyphenyl)methylideneamino]carbamoyl]phenyl]-2-chloranyl-4-nitro-benzamide Openeye Name: N-[2-[[(E)-(4-butoxyphenyl)methyleneamino]carbamoyl]phenyl]-2-chloro-4-nitro-benzamide CAS Name: N-[2-[[(2E)-2-[(4-butoxyphenyl)methylidene]hydrazinyl]-oxomethyl]phenyl]-2-chloro-4-nitrobenzamide IUPAC Name: N-[2-[[(E)-(4-butoxyphenyl)methylideneamino]carbamoyl]phenyl]-2-chloro-4-nitrobenzamide Traditional Name: N-[2-[[(E)-(4-butoxybenzylidene)amino]carbamoyl]phenyl]-2-chloro-4-nitro-benzamide Formula: C25H23ClN4O5 MolecularWeight: 494.92692

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=NNC(=O)C2=CC=CC=C2NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=N/NC(=O)C2=CC=CC=C2NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C25H23ClN4O5/c1-2-3-14-35-19-11-8-17(9-12-19)16-27-29-25(32)21-6-4-5-7-23(21)28-24(31)20-13-10-18(30(33)34)15-22(20)26/h4-13,15-16H,2-3,14H2,1H3,(H,28,31)(H,29,32)/b27-16+