(phenylmethyl) (2S)-2-[(Z)-(2-methoxy-6-oxidanylidene-7,8-dihydroquinolin-5-ylidene)-oxidanyl-methoxy]propanoate

Systemtic Name: (phenylmethyl) (2S)-2-[(Z)-(2-methoxy-6-oxidanylidene-7,8-dihydroquinolin-5-ylidene)-oxidanyl-methoxy]propanoate Openeye Name: benzyl (2S)-2-[(Z)-hydroxy-(2-methoxy-6-oxo-7,8-dihydroquinolin-5-ylidene)methoxy]propanoate CAS Name: (2S)-2-[(Z)-hydroxy-(2-methoxy-6-oxo-7,8-dihydroquinolin-5-ylidene)methoxy]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[(Z)-hydroxy-(2-methoxy-6-oxo-7,8-dihydroquinolin-5-ylidene)methoxy]propanoate Traditional Name: (2S)-2-[(Z)-hydroxy-(6-keto-2-methoxy-7,8-dihydroquinolin-5-ylidene)methoxy]propionic acid benzyl ester Formula: C21H21NO6 MolecularWeight: 383.39454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CC=CC=C1)OC(=C2C(=O)CCC3=C2C=CC(=N3)OC)O

Isomeric SMILES

C[C@@H](C(=O)OCC1=CC=CC=C1)O/C(=C/2\C(=O)CCC3=C2C=CC(=N3)OC)/O

InChI

InChI=1S/C21H21NO6/c1-13(20(24)27-12-14-6-4-3-5-7-14)28-21(25)19-15-8-11-18(26-2)22-16(15)9-10-17(19)23/h3-8,11,13,25H,9-10,12H2,1-2H3/b21-19-/t13-/m0/s1