methyl 3-chloranyl-2-[2-(9H-xanthen-9-yl)ethanoylamino]benzoate

Systemtic Name: methyl 3-chloranyl-2-[2-(9H-xanthen-9-yl)ethanoylamino]benzoate Openeye Name: methyl 3-chloro-2-[[2-(9H-xanthen-9-yl)acetyl]amino]benzoate CAS Name: 3-chloro-2-[[1-oxo-2-(9H-xanthen-9-yl)ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-chloro-2-[[2-(9H-xanthen-9-yl)acetyl]amino]benzoate Traditional Name: 3-chloro-2-[[2-(9H-xanthen-9-yl)acetyl]amino]benzoic acid methyl ester Formula: C23H18ClNO4 MolecularWeight: 407.84632

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=CC=C1)Cl)NC(=O)CC2C3=CC=CC=C3OC4=CC=CC=C24

Isomeric SMILES

COC(=O)C1=C(C(=CC=C1)Cl)NC(=O)CC2C3=CC=CC=C3OC4=CC=CC=C24

InChI

InChI=1S/C23H18ClNO4/c1-28-23(27)16-9-6-10-18(24)22(16)25-21(26)13-17-14-7-2-4-11-19(14)29-20-12-5-3-8-15(17)20/h2-12,17H,13H2,1H3,(H,25,26)