quinolin-3-yl 2-[[(3S)-2-oxidanylidene-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]pyrrolidin-1-yl]methyl]butanoate

Systemtic Name: quinolin-3-yl 2-[[(3S)-2-oxidanylidene-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]pyrrolidin-1-yl]methyl]butanoate Openeye Name: 3-quinolyl 2-[[(3S)-2-oxo-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]pyrrolidin-1-yl]methyl]butanoate CAS Name: 2-[[(3S)-2-oxo-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-1-pyrrolidinyl]methyl]butanoic acid 3-quinolinyl ester IUPAC Name: quinolin-3-yl 2-[[(3S)-2-oxo-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]pyrrolidin-1-yl]methyl]butanoate Traditional Name: 2-[[(3S)-2-keto-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]pyrrolidino]methyl]butyric acid 3-quinolyl ester Formula: C29H34N4O3 MolecularWeight: 486.60526

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN1CCC(C1=O)CCCC2=NC3=C(CCCN3)C=C2)C(=O)OC4=CC5=CC=CC=C5N=C4

Isomeric SMILES

CCC(CN1CC[C@@H](C1=O)CCCC2=NC3=C(CCCN3)C=C2)C(=O)OC4=CC5=CC=CC=C5N=C4

InChI

InChI=1S/C29H34N4O3/c1-2-20(29(35)36-25-17-23-7-3-4-11-26(23)31-18-25)19-33-16-14-22(28(33)34)8-5-10-24-13-12-21-9-6-15-30-27(21)32-24/h3-4,7,11-13,17-18,20,22H,2,5-6,8-10,14-16,19H2,1H3,(H,30,32)/t20?,22-/m0/s1