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

Systemtic Name: N-[2-[(2R)-2-(4-methoxyphenyl)pyrrolidin-1-yl]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-[2-[(2R)-2-(4-methoxyphenyl)pyrrolidin-1-yl]-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[2-[(2R)-2-(4-methoxyphenyl)-1-pyrrolidinyl]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-[2-[(2R)-2-(4-methoxyphenyl)pyrrolidin-1-yl]-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-[2-keto-2-[(2R)-2-(4-methoxyphenyl)pyrrolidino]ethyl]-3-nitro-benzamide Formula: C20H21N3O5 MolecularWeight: 383.39784

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCN2C(=O)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2CCCN2C(=O)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O5/c1-28-17-9-7-14(8-10-17)18-6-3-11-22(18)19(24)13-21-20(25)15-4-2-5-16(12-15)23(26)27/h2,4-5,7-10,12,18H,3,6,11,13H2,1H3,(H,21,25)/t18-/m1/s1