4-[(3S)-3-methylpiperidin-1-yl]-N-(4-morpholin-4-ylphenyl)-3-nitro-benzamide

Systemtic Name: 4-[(3S)-3-methylpiperidin-1-yl]-N-(4-morpholin-4-ylphenyl)-3-nitro-benzamide Openeye Name: 4-[(3S)-3-methyl-1-piperidyl]-N-(4-morpholinophenyl)-3-nitro-benzamide CAS Name: 4-[(3S)-3-methyl-1-piperidinyl]-N-[4-(4-morpholinyl)phenyl]-3-nitrobenzamide IUPAC Name: 4-[(3S)-3-methylpiperidin-1-yl]-N-(4-morpholin-4-ylphenyl)-3-nitrobenzamide Traditional Name: 4-[(3S)-3-methylpiperidino]-N-(4-morpholinophenyl)-3-nitro-benzamide Formula: C23H28N4O4 MolecularWeight: 424.49282

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CCCN(C1)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C23H28N4O4/c1-17-3-2-10-26(16-17)21-9-4-18(15-22(21)27(29)30)23(28)24-19-5-7-20(8-6-19)25-11-13-31-14-12-25/h4-9,15,17H,2-3,10-14,16H2,1H3,(H,24,28)/t17-/m0/s1