(7-methylnaphthalen-2-yl)sulfonyl 2-(butylamino)ethanoate

Systemtic Name: (7-methylnaphthalen-2-yl)sulfonyl 2-(butylamino)ethanoate Openeye Name: (7-methyl-2-naphthyl)sulfonyl 2-(butylamino)acetate CAS Name: 2-(butylamino)acetic acid (7-methyl-2-naphthalenyl)sulfonyl ester IUPAC Name: (7-methylnaphthalen-2-yl)sulfonyl 2-(butylamino)acetate Traditional Name: 2-(butylamino)acetic acid (7-methyl-2-naphthyl)sulfonyl ester Formula: C17H21NO4S MolecularWeight: 335.41794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCC(=O)OS(=O)(=O)C1=CC2=C(C=CC(=C2)C)C=C1

Isomeric SMILES

CCCCNCC(=O)OS(=O)(=O)C1=CC2=C(C=CC(=C2)C)C=C1

InChI

InChI=1S/C17H21NO4S/c1-3-4-9-18-12-17(19)22-23(20,21)16-8-7-14-6-5-13(2)10-15(14)11-16/h5-8,10-11,18H,3-4,9,12H2,1-2H3