[4-[(4-methoxyphenyl)carbamoyl]phenyl]methyl 4-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: [4-[(4-methoxyphenyl)carbamoyl]phenyl]methyl 4-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: [4-[(4-methoxyphenyl)carbamoyl]phenyl]methyl 4-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 4-(1-pyrrolidinylsulfonyl)benzoic acid [4-[(4-methoxyanilino)-oxomethyl]phenyl]methyl ester IUPAC Name: [4-[(4-methoxyphenyl)carbamoyl]phenyl]methyl 4-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-pyrrolidinosulfonylbenzoic acid [4-[(4-methoxyphenyl)carbamoyl]benzyl] ester Formula: C26H26N2O6S MolecularWeight: 494.55944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)COC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)COC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C26H26N2O6S/c1-33-23-12-10-22(11-13-23)27-25(29)20-6-4-19(5-7-20)18-34-26(30)21-8-14-24(15-9-21)35(31,32)28-16-2-3-17-28/h4-15H,2-3,16-18H2,1H3,(H,27,29)