4-azanyl-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-3-nitro-benzamide

Systemtic Name: 4-azanyl-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-3-nitro-benzamide Openeye Name: 4-amino-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-3-nitro-benzamide CAS Name: 4-amino-N-[2-(3-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-3-nitrobenzamide IUPAC Name: 4-amino-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-3-nitrobenzamide Traditional Name: 4-amino-N-[2-(3-methoxyphenyl)-2-pyrrolidino-ethyl]-3-nitro-benzamide Formula: C20H24N4O4 MolecularWeight: 384.42896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N4O4/c1-28-16-6-4-5-14(11-16)19(23-9-2-3-10-23)13-22-20(25)15-7-8-17(21)18(12-15)24(26)27/h4-8,11-12,19H,2-3,9-10,13,21H2,1H3,(H,22,25)