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

Systemtic Name: N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-2-methyl-3-nitro-benzamide Openeye Name: N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-2-methyl-3-nitro-benzamide CAS Name: N-[2-(2-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-2-methyl-3-nitrobenzamide Traditional Name: N-[2-(2-methoxyphenyl)-2-pyrrolidino-ethyl]-2-methyl-3-nitro-benzamide Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCC(C2=CC=CC=C2OC)N3CCCC3

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCC(C2=CC=CC=C2OC)N3CCCC3

InChI

InChI=1S/C21H25N3O4/c1-15-16(9-7-10-18(15)24(26)27)21(25)22-14-19(23-12-5-6-13-23)17-8-3-4-11-20(17)28-2/h3-4,7-11,19H,5-6,12-14H2,1-2H3,(H,22,25)