2-[[3-chloranyl-1,4-bis(oxidanylidene)naphthalen-2-yl]amino]butyl ethanoate

Systemtic Name: 2-[[3-chloranyl-1,4-bis(oxidanylidene)naphthalen-2-yl]amino]butyl ethanoate Openeye Name: 2-[(3-chloro-1,4-dioxo-2-naphthyl)amino]butyl acetate CAS Name: acetic acid 2-[(3-chloro-1,4-dioxo-2-naphthalenyl)amino]butyl ester IUPAC Name: 2-[(3-chloro-1,4-dioxonaphthalen-2-yl)amino]butyl acetate Traditional Name: acetic acid 2-[(3-chloro-1,4-diketo-2-naphthyl)amino]butyl ester Formula: C16H16ClNO4 MolecularWeight: 321.75554

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COC(=O)C)NC1=C(C(=O)C2=CC=CC=C2C1=O)Cl

Isomeric SMILES

CCC(COC(=O)C)NC1=C(C(=O)C2=CC=CC=C2C1=O)Cl

InChI

InChI=1S/C16H16ClNO4/c1-3-10(8-22-9(2)19)18-14-13(17)15(20)11-6-4-5-7-12(11)16(14)21/h4-7,10,18H,3,8H2,1-2H3