[2-(8aH-quinolin-1-ylcarbonyl)-6-[2-azanyl-3-(2-azanyloxolan-2-yl)-3-oxidanylidene-propyl]phenyl] ethanoate

Systemtic Name: [2-(8aH-quinolin-1-ylcarbonyl)-6-[2-azanyl-3-(2-azanyloxolan-2-yl)-3-oxidanylidene-propyl]phenyl] ethanoate Openeye Name: [2-[2-amino-3-(2-aminotetrahydrofuran-2-yl)-3-oxo-propyl]-6-(8aH-quinoline-1-carbonyl)phenyl] acetate CAS Name: acetic acid [2-[2-amino-3-(2-amino-2-oxolanyl)-3-oxopropyl]-6-[8aH-quinolin-1-yl(oxo)methyl]phenyl] ester IUPAC Name: [2-[2-amino-3-(2-aminooxolan-2-yl)-3-oxopropyl]-6-(8aH-quinoline-1-carbonyl)phenyl] acetate Traditional Name: acetic acid [2-[2-amino-3-(2-aminotetrahydrofuran-2-yl)-3-keto-propyl]-6-(8aH-quinoline-1-carbonyl)phenyl] ester Formula: C25H27N3O5 MolecularWeight: 449.49898

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=CC=C1CC(C(=O)C2(CCCO2)N)N)C(=O)N3C=CC=C4C3C=CC=C4

Isomeric SMILES

CC(=O)OC1=C(C=CC=C1CC(C(=O)C2(CCCO2)N)N)C(=O)N3C=CC=C4C3C=CC=C4

InChI

InChI=1S/C25H27N3O5/c1-16(29)33-22-18(15-20(26)23(30)25(27)12-6-14-32-25)8-4-10-19(22)24(31)28-13-5-9-17-7-2-3-11-21(17)28/h2-5,7-11,13,20-21H,6,12,14-15,26-27H2,1H3