N-(4-acetamido-3-chloranyl-phenyl)-5-nitro-2-pyrrolidin-1-yl-benzamide

Systemtic Name: N-(4-acetamido-3-chloranyl-phenyl)-5-nitro-2-pyrrolidin-1-yl-benzamide Openeye Name: N-(4-acetamido-3-chloro-phenyl)-5-nitro-2-pyrrolidin-1-yl-benzamide CAS Name: N-(4-acetamido-3-chlorophenyl)-5-nitro-2-(1-pyrrolidinyl)benzamide IUPAC Name: N-(4-acetamido-3-chlorophenyl)-5-nitro-2-pyrrolidin-1-ylbenzamide Traditional Name: N-(4-acetamido-3-chloro-phenyl)-5-nitro-2-pyrrolidino-benzamide Formula: C19H19ClN4O4 MolecularWeight: 402.83156

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3)Cl

InChI

InChI=1S/C19H19ClN4O4/c1-12(25)21-17-6-4-13(10-16(17)20)22-19(26)15-11-14(24(27)28)5-7-18(15)23-8-2-3-9-23/h4-7,10-11H,2-3,8-9H2,1H3,(H,21,25)(H,22,26)