[2-[(2-oxidanyl-3-pyrrolidin-1-yl-propyl)carbamoyl]-1-phenyl-indol-3-yl] 2,2-dimethylpropanoate

Systemtic Name: [2-[(2-oxidanyl-3-pyrrolidin-1-yl-propyl)carbamoyl]-1-phenyl-indol-3-yl] 2,2-dimethylpropanoate Openeye Name: [2-[(2-hydroxy-3-pyrrolidin-1-yl-propyl)carbamoyl]-1-phenyl-indol-3-yl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [2-[[[2-hydroxy-3-(1-pyrrolidinyl)propyl]amino]-oxomethyl]-1-phenyl-3-indolyl] ester IUPAC Name: [2-[(2-hydroxy-3-pyrrolidin-1-ylpropyl)carbamoyl]-1-phenylindol-3-yl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [2-[(2-hydroxy-3-pyrrolidino-propyl)carbamoyl]-1-phenyl-indol-3-yl] ester Formula: C27H33N3O4 MolecularWeight: 463.56862

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1=C(N(C2=CC=CC=C21)C3=CC=CC=C3)C(=O)NCC(CN4CCCC4)O

Isomeric SMILES

CC(C)(C)C(=O)OC1=C(N(C2=CC=CC=C21)C3=CC=CC=C3)C(=O)NCC(CN4CCCC4)O

InChI

InChI=1S/C27H33N3O4/c1-27(2,3)26(33)34-24-21-13-7-8-14-22(21)30(19-11-5-4-6-12-19)23(24)25(32)28-17-20(31)18-29-15-9-10-16-29/h4-8,11-14,20,31H,9-10,15-18H2,1-3H3,(H,28,32)