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

Systemtic Name: N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-yl-ethyl]-2-nitro-4-piperidin-1-ylsulfonyl-aniline Openeye Name: N-[(1R)-2-morpholino-1-(p-tolyl)ethyl]-2-nitro-4-(1-piperidylsulfonyl)aniline CAS Name: N-[(1R)-1-(4-methylphenyl)-2-(4-morpholinyl)ethyl]-2-nitro-4-(1-piperidinylsulfonyl)aniline IUPAC Name: N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]-2-nitro-4-piperidin-1-ylsulfonylaniline Traditional Name: [(1R)-2-morpholino-1-(p-tolyl)ethyl]-(2-nitro-4-piperidinosulfonyl-phenyl)amine Formula: C24H32N4O5S MolecularWeight: 488.59968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CN2CCOCC2)NC3=C(C=C(C=C3)S(=O)(=O)N4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](CN2CCOCC2)NC3=C(C=C(C=C3)S(=O)(=O)N4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C24H32N4O5S/c1-19-5-7-20(8-6-19)23(18-26-13-15-33-16-14-26)25-22-10-9-21(17-24(22)28(29)30)34(31,32)27-11-3-2-4-12-27/h5-10,17,23,25H,2-4,11-16,18H2,1H3/t23-/m0/s1