2-azanyl-4-[(10-methylanthracen-9-yl)methylsulfanyl]butanoic acid

Systemtic Name: 2-azanyl-4-[(10-methylanthracen-9-yl)methylsulfanyl]butanoic acid Openeye Name: 2-amino-4-[(10-methyl-9-anthryl)methylsulfanyl]butanoic acid CAS Name: 2-amino-4-[(10-methyl-9-anthracenyl)methylthio]butanoic acid IUPAC Name: 2-amino-4-[(10-methylanthracen-9-yl)methylsulfanyl]butanoic acid Traditional Name: 2-amino-4-[(10-methyl-9-anthryl)methylthio]butyric acid Formula: C20H21NO2S MolecularWeight: 339.45124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC=CC2=C(C3=CC=CC=C13)CSCCC(C(=O)O)N

Isomeric SMILES

CC1=C2C=CC=CC2=C(C3=CC=CC=C13)CSCCC(C(=O)O)N

InChI

InChI=1S/C20H21NO2S/c1-13-14-6-2-4-8-16(14)18(17-9-5-3-7-15(13)17)12-24-11-10-19(21)20(22)23/h2-9,19H,10-12,21H2,1H3,(H,22,23)