butyl 2-[[4-[4-(furan-2-yl)phenyl]sulfonylpiperidin-1-yl]carbonylamino]benzoate

Systemtic Name: butyl 2-[[4-[4-(furan-2-yl)phenyl]sulfonylpiperidin-1-yl]carbonylamino]benzoate Openeye Name: butyl 2-[[4-[4-(2-furyl)phenyl]sulfonylpiperidine-1-carbonyl]amino]benzoate CAS Name: 2-[[[4-[4-(2-furanyl)phenyl]sulfonyl-1-piperidinyl]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 2-[[4-[4-(furan-2-yl)phenyl]sulfonylpiperidine-1-carbonyl]amino]benzoate Traditional Name: 2-[[4-[4-(2-furyl)phenyl]sulfonylpiperidine-1-carbonyl]amino]benzoic acid butyl ester Formula: C27H30N2O6S MolecularWeight: 510.6019

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=CC=C1NC(=O)N2CCC(CC2)S(=O)(=O)C3=CC=C(C=C3)C4=CC=CO4

Isomeric SMILES

CCCCOC(=O)C1=CC=CC=C1NC(=O)N2CCC(CC2)S(=O)(=O)C3=CC=C(C=C3)C4=CC=CO4

InChI

InChI=1S/C27H30N2O6S/c1-2-3-18-35-26(30)23-7-4-5-8-24(23)28-27(31)29-16-14-22(15-17-29)36(32,33)21-12-10-20(11-13-21)25-9-6-19-34-25/h4-13,19,22H,2-3,14-18H2,1H3,(H,28,31)