1-[2,3-bis(oxidanyl)propyl]-4-[butyl-[(2,5-dimethoxyphenyl)carbamoyl]amino]-N-(2-diethylaminoethyl)pyrrolidine-2-carboxamide

Systemtic Name: 1-[2,3-bis(oxidanyl)propyl]-4-[butyl-[(2,5-dimethoxyphenyl)carbamoyl]amino]-N-(2-diethylaminoethyl)pyrrolidine-2-carboxamide Openeye Name: 4-[butyl-[(2,5-dimethoxyphenyl)carbamoyl]amino]-N-(2-diethylaminoethyl)-1-(2,3-dihydroxypropyl)pyrrolidine-2-carboxamide CAS Name: 4-[butyl-[(2,5-dimethoxyanilino)-oxomethyl]amino]-N-(2-diethylaminoethyl)-1-(2,3-dihydroxypropyl)-2-pyrrolidinecarboxamide IUPAC Name: 4-[butyl-[(2,5-dimethoxyphenyl)carbamoyl]amino]-N-(2-diethylaminoethyl)-1-(2,3-dihydroxypropyl)pyrrolidine-2-carboxamide Traditional Name: 4-[butyl-[(2,5-dimethoxyphenyl)carbamoyl]amino]-N-(2-diethylaminoethyl)-1-glyceryl-pyrrolidine-2-carboxamide Formula: C27H47N5O6 MolecularWeight: 537.69198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1CC(N(C1)CC(CO)O)C(=O)NCCN(CC)CC)C(=O)NC2=C(C=CC(=C2)OC)OC

Isomeric SMILES

CCCCN(C1CC(N(C1)CC(CO)O)C(=O)NCCN(CC)CC)C(=O)NC2=C(C=CC(=C2)OC)OC

InChI

InChI=1S/C27H47N5O6/c1-6-9-13-32(27(36)29-23-16-22(37-4)10-11-25(23)38-5)20-15-24(31(17-20)18-21(34)19-33)26(35)28-12-14-30(7-2)8-3/h10-11,16,20-21,24,33-34H,6-9,12-15,17-19H2,1-5H3,(H,28,35)(H,29,36)