[2-(3,4-dihydro-2H-chromen-4-ylamino)-2-oxidanylidene-ethyl] 2-(4-chlorophenyl)carbonylbenzoate

Systemtic Name: [2-(3,4-dihydro-2H-chromen-4-ylamino)-2-oxidanylidene-ethyl] 2-(4-chlorophenyl)carbonylbenzoate Openeye Name: [2-(chroman-4-ylamino)-2-oxo-ethyl] 2-(4-chlorobenzoyl)benzoate CAS Name: 2-[(4-chlorophenyl)-oxomethyl]benzoic acid [2-(3,4-dihydro-2H-1-benzopyran-4-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dihydro-2H-chromen-4-ylamino)-2-oxoethyl] 2-(4-chlorobenzoyl)benzoate Traditional Name: 2-(4-chlorobenzoyl)benzoic acid [2-(chroman-4-ylamino)-2-keto-ethyl] ester Formula: C25H20ClNO5 MolecularWeight: 449.883

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2C1NC(=O)COC(=O)C3=CC=CC=C3C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1COC2=CC=CC=C2C1NC(=O)COC(=O)C3=CC=CC=C3C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H20ClNO5/c26-17-11-9-16(10-12-17)24(29)18-5-1-2-6-19(18)25(30)32-15-23(28)27-21-13-14-31-22-8-4-3-7-20(21)22/h1-12,21H,13-15H2,(H,27,28)