ethyl 3-[(3-azanyl-4,4-dimethyl-6-oxidanyl-2,3-dihydro-1H-naphthalen-2-yl)sulfanyl]propanoate

Systemtic Name: ethyl 3-[(3-azanyl-4,4-dimethyl-6-oxidanyl-2,3-dihydro-1H-naphthalen-2-yl)sulfanyl]propanoate Openeye Name: ethyl 3-(3-amino-6-hydroxy-4,4-dimethyl-tetralin-2-yl)sulfanylpropanoate CAS Name: 3-[(3-amino-6-hydroxy-4,4-dimethyl-2,3-dihydro-1H-naphthalen-2-yl)thio]propanoic acid ethyl ester IUPAC Name: ethyl 3-[(3-amino-6-hydroxy-4,4-dimethyl-2,3-dihydro-1H-naphthalen-2-yl)sulfanyl]propanoate Traditional Name: 3-[(3-amino-6-hydroxy-4,4-dimethyl-tetralin-2-yl)thio]propionic acid ethyl ester Formula: C17H25NO3S MolecularWeight: 323.4503

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCSC1CC2=C(C=C(C=C2)O)C(C1N)(C)C

Isomeric SMILES

CCOC(=O)CCSC1CC2=C(C=C(C=C2)O)C(C1N)(C)C

InChI

InChI=1S/C17H25NO3S/c1-4-21-15(20)7-8-22-14-9-11-5-6-12(19)10-13(11)17(2,3)16(14)18/h5-6,10,14,16,19H,4,7-9,18H2,1-3H3