[2-[5-(3-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl]-(4-nitrophenyl)methanone

Systemtic Name: [2-[5-(3-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl]-(4-nitrophenyl)methanone Openeye Name: [2-[5-(3-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl]-(4-nitrophenyl)methanone CAS Name: [2-[5-(3-methoxyphenyl)-1,3-benzoxazol-2-yl]-1-pyrrolidinyl]-(4-nitrophenyl)methanone IUPAC Name: [2-[5-(3-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl]-(4-nitrophenyl)methanone Traditional Name: [2-[5-(3-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidino]-(4-nitrophenyl)methanone Formula: C25H21N3O5 MolecularWeight: 443.45134

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=CC3=C(C=C2)OC(=N3)C4CCCN4C(=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)C2=CC3=C(C=C2)OC(=N3)C4CCCN4C(=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C25H21N3O5/c1-32-20-5-2-4-17(14-20)18-9-12-23-21(15-18)26-24(33-23)22-6-3-13-27(22)25(29)16-7-10-19(11-8-16)28(30)31/h2,4-5,7-12,14-15,22H,3,6,13H2,1H3