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

Systemtic Name: (2S)-2-[[3-chloranyl-1,4-bis(oxidanylidene)naphthalen-2-yl]amino]-3-methyl-butanoate Openeye Name: (2S)-2-[(3-chloro-1,4-dioxo-2-naphthyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[(3-chloro-1,4-dioxo-2-naphthalenyl)amino]-3-methylbutanoate IUPAC Name: (2S)-2-[(3-chloro-1,4-dioxonaphthalen-2-yl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(3-chloro-1,4-diketo-2-naphthyl)amino]-3-methyl-butyrate Formula: C15H13ClNO4- MolecularWeight: 306.72102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])NC1=C(C(=O)C2=CC=CC=C2C1=O)Cl

Isomeric SMILES

CC(C)[C@@H](C(=O)[O-])NC1=C(C(=O)C2=CC=CC=C2C1=O)Cl

InChI

InChI=1S/C15H14ClNO4/c1-7(2)11(15(20)21)17-12-10(16)13(18)8-5-3-4-6-9(8)14(12)19/h3-7,11,17H,1-2H3,(H,20,21)/p-1/t11-/m0/s1