N-[(E)-(4-chloranyl-3-nitro-phenyl)methylideneamino]-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(E)-(4-chloranyl-3-nitro-phenyl)methylideneamino]-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[(E)-(4-chloro-3-nitro-phenyl)methyleneamino]-3-(1-piperidylsulfonyl)benzamide CAS Name: N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[(E)-(4-chloro-3-nitro-benzylidene)amino]-3-piperidinosulfonyl-benzamide Formula: C19H19ClN4O5S MolecularWeight: 450.89596

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NN=CC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N/N=C/C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H19ClN4O5S/c20-17-8-7-14(11-18(17)24(26)27)13-21-22-19(25)15-5-4-6-16(12-15)30(28,29)23-9-2-1-3-10-23/h4-8,11-13H,1-3,9-10H2,(H,22,25)/b21-13+