(3-azanyl-3-oxidanylidene-propyl) 4-[2-[(5-chloranyl-2-methoxy-phenyl)amino]-2-oxidanylidene-ethoxy]-3-methoxy-benzoate

Systemtic Name: (3-azanyl-3-oxidanylidene-propyl) 4-[2-[(5-chloranyl-2-methoxy-phenyl)amino]-2-oxidanylidene-ethoxy]-3-methoxy-benzoate Openeye Name: (3-amino-3-oxo-propyl) 4-[2-(5-chloro-2-methoxy-anilino)-2-oxo-ethoxy]-3-methoxy-benzoate CAS Name: 4-[2-(5-chloro-2-methoxyanilino)-2-oxoethoxy]-3-methoxybenzoic acid (3-amino-3-oxopropyl) ester IUPAC Name: (3-amino-3-oxopropyl) 4-[2-(5-chloro-2-methoxyanilino)-2-oxoethoxy]-3-methoxybenzoate Traditional Name: 4-[2-(5-chloro-2-methoxy-anilino)-2-keto-ethoxy]-3-methoxy-benzoic acid (3-amino-3-keto-propyl) ester Formula: C20H21ClN2O7 MolecularWeight: 436.84294

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)COC2=C(C=C(C=C2)C(=O)OCCC(=O)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)COC2=C(C=C(C=C2)C(=O)OCCC(=O)N)OC

InChI

InChI=1S/C20H21ClN2O7/c1-27-15-6-4-13(21)10-14(15)23-19(25)11-30-16-5-3-12(9-17(16)28-2)20(26)29-8-7-18(22)24/h3-6,9-10H,7-8,11H2,1-2H3,(H2,22,24)(H,23,25)