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

Systemtic Name: N-[2-(furan-2-yl)-2-piperidin-1-yl-ethyl]-2-morpholin-4-ylsulfonyl-4-nitro-aniline Openeye Name: N-[2-(2-furyl)-2-(1-piperidyl)ethyl]-2-morpholinosulfonyl-4-nitro-aniline CAS Name: N-[2-(2-furanyl)-2-(1-piperidinyl)ethyl]-2-(4-morpholinylsulfonyl)-4-nitroaniline IUPAC Name: N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-morpholin-4-ylsulfonyl-4-nitroaniline Traditional Name: [2-(2-furyl)-2-piperidino-ethyl]-(2-morpholinosulfonyl-4-nitro-phenyl)amine Formula: C21H28N4O6S MolecularWeight: 464.53522

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(CNC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3)C4=CC=CO4

Isomeric SMILES

C1CCN(CC1)C(CNC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3)C4=CC=CO4

InChI

InChI=1S/C21H28N4O6S/c26-25(27)17-6-7-18(21(15-17)32(28,29)24-10-13-30-14-11-24)22-16-19(20-5-4-12-31-20)23-8-2-1-3-9-23/h4-7,12,15,19,22H,1-3,8-11,13-14,16H2