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

Systemtic Name: N-[2-[(2R)-2-(4-ethoxyphenyl)pyrrolidin-1-yl]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-[2-[(2R)-2-(4-ethoxyphenyl)pyrrolidin-1-yl]-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[2-[(2R)-2-(4-ethoxyphenyl)-1-pyrrolidinyl]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-[2-[(2R)-2-(4-ethoxyphenyl)pyrrolidin-1-yl]-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-[2-keto-2-[(2R)-2-p-phenetylpyrrolidino]ethyl]-3-nitro-benzamide Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2CCCN2C(=O)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)[C@H]2CCCN2C(=O)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O5/c1-2-29-18-10-8-15(9-11-18)19-7-4-12-23(19)20(25)14-22-21(26)16-5-3-6-17(13-16)24(27)28/h3,5-6,8-11,13,19H,2,4,7,12,14H2,1H3,(H,22,26)/t19-/m1/s1