N-[(3-methoxyphenyl)methyl]-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[(3-methoxyphenyl)methyl]-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[(3-methoxyphenyl)methyl]-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[(3-methoxyphenyl)methyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[(3-methoxyphenyl)methyl]-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-m-anisyl-3-nitro-4-pyrrolidino-benzamide Formula: C19H21N3O4 MolecularWeight: 355.38774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)CNC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O4/c1-26-16-6-4-5-14(11-16)13-20-19(23)15-7-8-17(18(12-15)22(24)25)21-9-2-3-10-21/h4-8,11-12H,2-3,9-10,13H2,1H3,(H,20,23)