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

Systemtic Name: 4-[(3R)-3-methylpiperidin-1-yl]-N-(2-methyl-6-propan-2-yl-phenyl)-3-nitro-benzamide Openeye Name: N-(2-isopropyl-6-methyl-phenyl)-4-[(3R)-3-methyl-1-piperidyl]-3-nitro-benzamide CAS Name: 4-[(3R)-3-methyl-1-piperidinyl]-N-(2-methyl-6-propan-2-ylphenyl)-3-nitrobenzamide IUPAC Name: 4-[(3R)-3-methylpiperidin-1-yl]-N-(2-methyl-6-propan-2-ylphenyl)-3-nitrobenzamide Traditional Name: N-(2-isopropyl-6-methyl-phenyl)-4-[(3R)-3-methylpiperidino]-3-nitro-benzamide Formula: C23H29N3O3 MolecularWeight: 395.49466

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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)[N+](=O)[O-]

Isomeric SMILES

C[C@@H]1CCCN(C1)C2=C(C=C(C=C2)C(=O)NC3=C(C=CC=C3C(C)C)C)[N+](=O)[O-]

InChI

InChI=1S/C23H29N3O3/c1-15(2)19-9-5-8-17(4)22(19)24-23(27)18-10-11-20(21(13-18)26(28)29)25-12-6-7-16(3)14-25/h5,8-11,13,15-16H,6-7,12,14H2,1-4H3,(H,24,27)/t16-/m1/s1