N-[4-chloranyl-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-3-nitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-[4-chloranyl-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-[4-chloro-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-[4-chloro-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-[4-chloro-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-[4-chloro-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-3-nitro-4-piperidino-benzamide Formula: C26H23ClN4O4 MolecularWeight: 490.93822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=N2)C3=C(C=CC(=C3)NC(=O)C4=CC(=C(C=C4)N5CCCCC5)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=N2)C3=C(C=CC(=C3)NC(=O)C4=CC(=C(C=C4)N5CCCCC5)[N+](=O)[O-])Cl

InChI

InChI=1S/C26H23ClN4O4/c1-16-5-10-24-21(13-16)29-26(35-24)19-15-18(7-8-20(19)27)28-25(32)17-6-9-22(23(14-17)31(33)34)30-11-3-2-4-12-30/h5-10,13-15H,2-4,11-12H2,1H3,(H,28,32)