N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-2-nitro-4-piperidin-1-ylsulfonyl-aniline

Systemtic Name: N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-2-nitro-4-piperidin-1-ylsulfonyl-aniline Openeye Name: N-(2-morpholino-2-tetrahydrofuran-3-yl-ethyl)-2-nitro-4-(1-piperidylsulfonyl)aniline CAS Name: N-[2-(4-morpholinyl)-2-(3-oxolanyl)ethyl]-2-nitro-4-(1-piperidinylsulfonyl)aniline IUPAC Name: N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-2-nitro-4-piperidin-1-ylsulfonylaniline Traditional Name: (2-morpholino-2-tetrahydrofuran-3-yl-ethyl)-(2-nitro-4-piperidinosulfonyl-phenyl)amine Formula: C21H32N4O6S MolecularWeight: 468.56698

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NCC(C3CCOC3)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NCC(C3CCOC3)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C21H32N4O6S/c26-25(27)20-14-18(32(28,29)24-7-2-1-3-8-24)4-5-19(20)22-15-21(17-6-11-31-16-17)23-9-12-30-13-10-23/h4-5,14,17,21-22H,1-3,6-13,15-16H2