tert-butyl 8-[(3S,4R)-4-ethoxycarbonyl-1-(phenylmethyl)pyrrolidin-3-yl]-3,4-dihydro-2H-quinoline-1-carboxylate

Systemtic Name: tert-butyl 8-[(3S,4R)-4-ethoxycarbonyl-1-(phenylmethyl)pyrrolidin-3-yl]-3,4-dihydro-2H-quinoline-1-carboxylate Openeye Name: tert-butyl 8-[(3S,4R)-1-benzyl-4-ethoxycarbonyl-pyrrolidin-3-yl]-3,4-dihydro-2H-quinoline-1-carboxylate CAS Name: 8-[(3S,4R)-4-ethoxycarbonyl-1-(phenylmethyl)-3-pyrrolidinyl]-3,4-dihydro-2H-quinoline-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 8-[(3S,4R)-1-benzyl-4-ethoxycarbonylpyrrolidin-3-yl]-3,4-dihydro-2H-quinoline-1-carboxylate Traditional Name: 8-[(3S,4R)-1-benzyl-4-carbethoxy-pyrrolidin-3-yl]-3,4-dihydro-2H-quinoline-1-carboxylic acid tert-butyl ester Formula: C28H36N2O4 MolecularWeight: 464.59644

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CN(CC1C2=CC=CC3=C2N(CCC3)C(=O)OC(C)(C)C)CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)[C@H]1CN(C[C@@H]1C2=CC=CC3=C2N(CCC3)C(=O)OC(C)(C)C)CC4=CC=CC=C4

InChI

InChI=1S/C28H36N2O4/c1-5-33-26(31)24-19-29(17-20-11-7-6-8-12-20)18-23(24)22-15-9-13-21-14-10-16-30(25(21)22)27(32)34-28(2,3)4/h6-9,11-13,15,23-24H,5,10,14,16-19H2,1-4H3/t23-,24+/m1/s1