ethyl (4S)-4-(6-chloranyl-1H-indol-3-yl)-2-oxidanylidene-5-phenylmethoxy-pentanoate

Systemtic Name: ethyl (4S)-4-(6-chloranyl-1H-indol-3-yl)-2-oxidanylidene-5-phenylmethoxy-pentanoate Openeye Name: ethyl (4S)-5-benzyloxy-4-(6-chloro-1H-indol-3-yl)-2-oxo-pentanoate CAS Name: (4S)-4-(6-chloro-1H-indol-3-yl)-2-oxo-5-phenylmethoxypentanoic acid ethyl ester IUPAC Name: ethyl (4S)-4-(6-chloro-1H-indol-3-yl)-2-oxo-5-phenylmethoxypentanoate Traditional Name: (4S)-5-benzoxy-4-(6-chloro-1H-indol-3-yl)-2-keto-valeric acid ethyl ester Formula: C22H22ClNO4 MolecularWeight: 399.86738

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)CC(COCC1=CC=CC=C1)C2=CNC3=C2C=CC(=C3)Cl

Isomeric SMILES

CCOC(=O)C(=O)C[C@H](COCC1=CC=CC=C1)C2=CNC3=C2C=CC(=C3)Cl

InChI

InChI=1S/C22H22ClNO4/c1-2-28-22(26)21(25)10-16(14-27-13-15-6-4-3-5-7-15)19-12-24-20-11-17(23)8-9-18(19)20/h3-9,11-12,16,24H,2,10,13-14H2,1H3/t16-/m1/s1