N-(2-methyl-2-morpholin-4-yl-propyl)-4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-aniline

Systemtic Name: N-(2-methyl-2-morpholin-4-yl-propyl)-4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-aniline Openeye Name: N-(2-methyl-2-morpholino-propyl)-4-[(4-methyl-1-piperidyl)sulfonyl]-2-nitro-aniline CAS Name: N-[2-methyl-2-(4-morpholinyl)propyl]-4-[(4-methyl-1-piperidinyl)sulfonyl]-2-nitroaniline IUPAC Name: N-(2-methyl-2-morpholin-4-ylpropyl)-4-(4-methylpiperidin-1-yl)sulfonyl-2-nitroaniline Traditional Name: (2-methyl-2-morpholino-propyl)-[4-(4-methylpiperidino)sulfonyl-2-nitro-phenyl]amine Formula: C20H32N4O5S MolecularWeight: 440.55688

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NCC(C)(C)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NCC(C)(C)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H32N4O5S/c1-16-6-8-23(9-7-16)30(27,28)17-4-5-18(19(14-17)24(25)26)21-15-20(2,3)22-10-12-29-13-11-22/h4-5,14,16,21H,6-13,15H2,1-3H3