N-[(1S)-2-methyl-1-phenyl-propyl]-2-morpholin-4-ylsulfonyl-4-nitro-aniline

Systemtic Name: N-[(1S)-2-methyl-1-phenyl-propyl]-2-morpholin-4-ylsulfonyl-4-nitro-aniline Openeye Name: N-[(1S)-2-methyl-1-phenyl-propyl]-2-morpholinosulfonyl-4-nitro-aniline CAS Name: N-[(1S)-2-methyl-1-phenylpropyl]-2-(4-morpholinylsulfonyl)-4-nitroaniline IUPAC Name: N-[(1S)-2-methyl-1-phenylpropyl]-2-morpholin-4-ylsulfonyl-4-nitroaniline Traditional Name: [(1S)-2-methyl-1-phenyl-propyl]-(2-morpholinosulfonyl-4-nitro-phenyl)amine Formula: C20H25N3O5S MolecularWeight: 419.4946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=CC=C1)NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC(C)[C@@H](C1=CC=CC=C1)NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C20H25N3O5S/c1-15(2)20(16-6-4-3-5-7-16)21-18-9-8-17(23(24)25)14-19(18)29(26,27)22-10-12-28-13-11-22/h3-9,14-15,20-21H,10-13H2,1-2H3/t20-/m0/s1