cyclopentyl (2S)-2-azanyl-4-[4-(4-benzamidophenoxy)-6-methoxy-quinolin-7-yl]oxy-butanoate

Systemtic Name: cyclopentyl (2S)-2-azanyl-4-[4-(4-benzamidophenoxy)-6-methoxy-quinolin-7-yl]oxy-butanoate Openeye Name: cyclopentyl (2S)-2-amino-4-[[4-(4-benzamidophenoxy)-6-methoxy-7-quinolyl]oxy]butanoate CAS Name: (2S)-2-amino-4-[[4-(4-benzamidophenoxy)-6-methoxy-7-quinolinyl]oxy]butanoic acid cyclopentyl ester IUPAC Name: cyclopentyl (2S)-2-amino-4-[4-(4-benzamidophenoxy)-6-methoxyquinolin-7-yl]oxybutanoate Traditional Name: (2S)-2-amino-4-[[4-(4-benzamidophenoxy)-6-methoxy-7-quinolyl]oxy]butyric acid cyclopentyl ester Formula: C32H33N3O6 MolecularWeight: 555.62092

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1OCCC(C(=O)OC3CCCC3)N)OC4=CC=C(C=C4)NC(=O)C5=CC=CC=C5

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1OCC[C@@H](C(=O)OC3CCCC3)N)OC4=CC=C(C=C4)NC(=O)C5=CC=CC=C5

InChI

InChI=1S/C32H33N3O6/c1-38-29-19-25-27(20-30(29)39-18-16-26(33)32(37)41-23-9-5-6-10-23)34-17-15-28(25)40-24-13-11-22(12-14-24)35-31(36)21-7-3-2-4-8-21/h2-4,7-8,11-15,17,19-20,23,26H,5-6,9-10,16,18,33H2,1H3,(H,35,36)/t26-/m0/s1