2-morpholin-4-ylsulfonyl-4-nitro-N-[(1-phenylcyclobutyl)methyl]aniline

Systemtic Name: 2-morpholin-4-ylsulfonyl-4-nitro-N-[(1-phenylcyclobutyl)methyl]aniline Openeye Name: 2-morpholinosulfonyl-4-nitro-N-[(1-phenylcyclobutyl)methyl]aniline CAS Name: 2-(4-morpholinylsulfonyl)-4-nitro-N-[(1-phenylcyclobutyl)methyl]aniline IUPAC Name: 2-morpholin-4-ylsulfonyl-4-nitro-N-[(1-phenylcyclobutyl)methyl]aniline Traditional Name: (2-morpholinosulfonyl-4-nitro-phenyl)-[(1-phenylcyclobutyl)methyl]amine Formula: C21H25N3O5S MolecularWeight: 431.5053

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)(CNC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3)C4=CC=CC=C4

Isomeric SMILES

C1CC(C1)(CNC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C21H25N3O5S/c25-24(26)18-7-8-19(20(15-18)30(27,28)23-11-13-29-14-12-23)22-16-21(9-4-10-21)17-5-2-1-3-6-17/h1-3,5-8,15,22H,4,9-14,16H2