N-[(1S)-2-morpholin-4-yl-1-phenyl-ethyl]-2-nitro-4-piperidin-1-ylsulfonyl-aniline

Systemtic Name: N-[(1S)-2-morpholin-4-yl-1-phenyl-ethyl]-2-nitro-4-piperidin-1-ylsulfonyl-aniline Openeye Name: N-[(1S)-2-morpholino-1-phenyl-ethyl]-2-nitro-4-(1-piperidylsulfonyl)aniline CAS Name: N-[(1S)-2-(4-morpholinyl)-1-phenylethyl]-2-nitro-4-(1-piperidinylsulfonyl)aniline IUPAC Name: N-[(1S)-2-morpholin-4-yl-1-phenylethyl]-2-nitro-4-piperidin-1-ylsulfonylaniline Traditional Name: [(1S)-2-morpholino-1-phenyl-ethyl]-(2-nitro-4-piperidinosulfonyl-phenyl)amine Formula: C23H30N4O5S MolecularWeight: 474.5731

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NC(CN3CCOCC3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N[C@H](CN3CCOCC3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H30N4O5S/c28-27(29)23-17-20(33(30,31)26-11-5-2-6-12-26)9-10-21(23)24-22(19-7-3-1-4-8-19)18-25-13-15-32-16-14-25/h1,3-4,7-10,17,22,24H,2,5-6,11-16,18H2/t22-/m1/s1