N-[2,6-di(propan-2-yl)phenyl]-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide

Systemtic Name: N-[2,6-di(propan-2-yl)phenyl]-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-(2,6-diisopropylphenyl)-4-(3-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-[2,6-di(propan-2-yl)phenyl]-4-(3-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-[2,6-di(propan-2-yl)phenyl]-4-(3-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-(2,6-diisopropylphenyl)-4-(3-methylpiperidino)-3-nitro-benzamide Formula: C25H33N3O3 MolecularWeight: 423.54782

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NC3=C(C=CC=C3C(C)C)C(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NC3=C(C=CC=C3C(C)C)C(C)C)[N+](=O)[O-]

InChI

InChI=1S/C25H33N3O3/c1-16(2)20-9-6-10-21(17(3)4)24(20)26-25(29)19-11-12-22(23(14-19)28(30)31)27-13-7-8-18(5)15-27/h6,9-12,14,16-18H,7-8,13,15H2,1-5H3,(H,26,29)