methyl 2-[4-[[5-(cyclopropylcarbonylamino)-2-methyl-phenyl]carbamoyl]piperidin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 2-[4-[[5-(cyclopropylcarbonylamino)-2-methyl-phenyl]carbamoyl]piperidin-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[[4-[[5-(cyclopropanecarbonylamino)-2-methyl-phenyl]carbamoyl]-1-piperidyl]sulfonyl]benzoate CAS Name: 2-[[4-[[5-[[cyclopropyl(oxo)methyl]amino]-2-methylanilino]-oxomethyl]-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[[5-(cyclopropanecarbonylamino)-2-methylphenyl]carbamoyl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 2-[4-[[5-(cyclopropanecarbonylamino)-2-methyl-phenyl]carbamoyl]piperidino]sulfonylbenzoic acid methyl ester Formula: C25H29N3O6S MolecularWeight: 499.57926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CC2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C(=O)OC

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CC2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C(=O)OC

InChI

InChI=1S/C25H29N3O6S/c1-16-7-10-19(26-23(29)17-8-9-17)15-21(16)27-24(30)18-11-13-28(14-12-18)35(32,33)22-6-4-3-5-20(22)25(31)34-2/h3-7,10,15,17-18H,8-9,11-14H2,1-2H3,(H,26,29)(H,27,30)