butyl 4-[[(E)-[8-chloranyl-2,4-bis(oxidanylidene)chromen-3-ylidene]methyl]amino]benzoate

Systemtic Name: butyl 4-[[(E)-[8-chloranyl-2,4-bis(oxidanylidene)chromen-3-ylidene]methyl]amino]benzoate Openeye Name: butyl 4-[[(E)-(8-chloro-2,4-dioxo-chroman-3-ylidene)methyl]amino]benzoate CAS Name: 4-[[(E)-(8-chloro-2,4-dioxo-3,4-dihydro-2H-1-benzopyran-3-ylidene)methyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[(E)-(8-chloro-2,4-dioxochromen-3-ylidene)methyl]amino]benzoate Traditional Name: 4-[[(E)-(8-chloro-2,4-diketo-chroman-3-ylidene)methyl]amino]benzoic acid butyl ester Formula: C21H18ClNO5 MolecularWeight: 399.82432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC=C2C(=O)C3=C(C(=CC=C3)Cl)OC2=O

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)N/C=C/2\C(=O)C3=C(C(=CC=C3)Cl)OC2=O

InChI

InChI=1S/C21H18ClNO5/c1-2-3-11-27-20(25)13-7-9-14(10-8-13)23-12-16-18(24)15-5-4-6-17(22)19(15)28-21(16)26/h4-10,12,23H,2-3,11H2,1H3/b16-12+