4,5-dimethoxy-N-[(2S)-2-naphthalen-1-yl-2-pyrrolidin-1-yl-ethyl]-2-nitro-benzamide

Systemtic Name: 4,5-dimethoxy-N-[(2S)-2-naphthalen-1-yl-2-pyrrolidin-1-yl-ethyl]-2-nitro-benzamide Openeye Name: 4,5-dimethoxy-N-[(2S)-2-(1-naphthyl)-2-pyrrolidin-1-yl-ethyl]-2-nitro-benzamide CAS Name: 4,5-dimethoxy-N-[(2S)-2-(1-naphthalenyl)-2-(1-pyrrolidinyl)ethyl]-2-nitrobenzamide IUPAC Name: 4,5-dimethoxy-N-[(2S)-2-naphthalen-1-yl-2-pyrrolidin-1-ylethyl]-2-nitrobenzamide Traditional Name: 4,5-dimethoxy-N-[(2S)-2-(1-naphthyl)-2-pyrrolidino-ethyl]-2-nitro-benzamide Formula: C25H27N3O5 MolecularWeight: 449.49898

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)NCC(C2=CC=CC3=CC=CC=C32)N4CCCC4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)NC[C@H](C2=CC=CC3=CC=CC=C32)N4CCCC4)[N+](=O)[O-])OC

InChI

InChI=1S/C25H27N3O5/c1-32-23-14-20(21(28(30)31)15-24(23)33-2)25(29)26-16-22(27-12-5-6-13-27)19-11-7-9-17-8-3-4-10-18(17)19/h3-4,7-11,14-15,22H,5-6,12-13,16H2,1-2H3,(H,26,29)/t22-/m1/s1