2-azanyl-7-chloranyl-2-naphthalen-2-yl-4-oxidanylidene-octanoic acid

Systemtic Name: 2-azanyl-7-chloranyl-2-naphthalen-2-yl-4-oxidanylidene-octanoic acid Openeye Name: 2-amino-7-chloro-2-(2-naphthyl)-4-oxo-octanoic acid CAS Name: 2-amino-7-chloro-2-(2-naphthalenyl)-4-oxooctanoic acid IUPAC Name: 2-amino-7-chloro-2-naphthalen-2-yl-4-oxooctanoic acid Traditional Name: 2-amino-7-chloro-4-keto-2-(2-naphthyl)caprylic acid Formula: C18H20ClNO3 MolecularWeight: 333.8093

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)CC(C1=CC2=CC=CC=C2C=C1)(C(=O)O)N)Cl

Isomeric SMILES

CC(CCC(=O)CC(C1=CC2=CC=CC=C2C=C1)(C(=O)O)N)Cl

InChI

InChI=1S/C18H20ClNO3/c1-12(19)6-9-16(21)11-18(20,17(22)23)15-8-7-13-4-2-3-5-14(13)10-15/h2-5,7-8,10,12H,6,9,11,20H2,1H3,(H,22,23)