[4-azanyl-1-(6-ethylnaphthalen-2-yl)-4-oxidanylidene-butan-2-yl] methanesulfonate

Systemtic Name: [4-azanyl-1-(6-ethylnaphthalen-2-yl)-4-oxidanylidene-butan-2-yl] methanesulfonate Openeye Name: [3-amino-1-[(6-ethyl-2-naphthyl)methyl]-3-oxo-propyl] methanesulfonate CAS Name: methanesulfonic acid [4-amino-1-(6-ethyl-2-naphthalenyl)-4-oxobutan-2-yl] ester IUPAC Name: [4-amino-1-(6-ethylnaphthalen-2-yl)-4-oxobutan-2-yl] methanesulfonate Traditional Name: methanesulfonic acid [3-amino-1-[(6-ethyl-2-naphthyl)methyl]-3-keto-propyl] ester Formula: C17H21NO4S MolecularWeight: 335.41794

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C=C(C=C2)CC(CC(=O)N)OS(=O)(=O)C

Isomeric SMILES

CCC1=CC2=C(C=C1)C=C(C=C2)CC(CC(=O)N)OS(=O)(=O)C

InChI

InChI=1S/C17H21NO4S/c1-3-12-4-6-15-9-13(5-7-14(15)8-12)10-16(11-17(18)19)22-23(2,20)21/h4-9,16H,3,10-11H2,1-2H3,(H2,18,19)