2-[[3-chloranyl-1,4-bis(oxidanylidene)naphthalen-2-yl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[3-chloranyl-1,4-bis(oxidanylidene)naphthalen-2-yl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[(3-chloro-1,4-dioxo-2-naphthyl)amino]-4-methyl-pentanoic acid CAS Name: 2-[(3-chloro-1,4-dioxo-2-naphthalenyl)amino]-4-methylpentanoic acid IUPAC Name: 2-[(3-chloro-1,4-dioxonaphthalen-2-yl)amino]-4-methylpentanoic acid Traditional Name: 2-[(3-chloro-1,4-diketo-2-naphthyl)amino]-4-methyl-valeric acid Formula: C16H16ClNO4 MolecularWeight: 321.75554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16ClNO4/c1-8(2)7-11(16(21)22)18-13-12(17)14(19)9-5-3-4-6-10(9)15(13)20/h3-6,8,11,18H,7H2,1-2H3,(H,21,22)