N-(2-naphthalen-1-yl-1,3-benzoxazol-5-yl)-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-(2-naphthalen-1-yl-1,3-benzoxazol-5-yl)-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[2-(1-naphthyl)-1,3-benzoxazol-5-yl]-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[2-(1-naphthalenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-(2-naphthalen-1-yl-1,3-benzoxazol-5-yl)-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-[2-(1-naphthyl)-1,3-benzoxazol-5-yl]-3-nitro-4-pyrrolidino-benzamide Formula: C28H22N4O4 MolecularWeight: 478.49868

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC3=CC4=C(C=C3)OC(=N4)C5=CC=CC6=CC=CC=C65)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC3=CC4=C(C=C3)OC(=N4)C5=CC=CC6=CC=CC=C65)[N+](=O)[O-]

InChI

InChI=1S/C28H22N4O4/c33-27(19-10-12-24(25(16-19)32(34)35)31-14-3-4-15-31)29-20-11-13-26-23(17-20)30-28(36-26)22-9-5-7-18-6-1-2-8-21(18)22/h1-2,5-13,16-17H,3-4,14-15H2,(H,29,33)