N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-4-nitro-2,1,3-benzoxadiazol-7-amine

Systemtic Name: N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-4-nitro-2,1,3-benzoxadiazol-7-amine Openeye Name: N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-4-nitro-2,1,3-benzoxadiazol-7-amine CAS Name: N-[2-(4-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-4-nitro-2,1,3-benzoxadiazol-7-amine IUPAC Name: N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4-nitro-2,1,3-benzoxadiazol-7-amine Traditional Name: [2-(4-methoxyphenyl)-2-pyrrolidino-ethyl]-(7-nitrobenzofurazan-4-yl)amine Formula: C19H21N5O4 MolecularWeight: 383.40114

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC2=CC=C(C3=NON=C23)[N+](=O)[O-])N4CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C(CNC2=CC=C(C3=NON=C23)[N+](=O)[O-])N4CCCC4

InChI

InChI=1S/C19H21N5O4/c1-27-14-6-4-13(5-7-14)17(23-10-2-3-11-23)12-20-15-8-9-16(24(25)26)19-18(15)21-28-22-19/h4-9,17,20H,2-3,10-12H2,1H3