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(2S)-2-(1-adamantyl)-2-[(4-methylphenyl)sulfonylamino]ethanoate

Systemtic Name:	(2S)-2-(1-adamantyl)-2-[(4-methylphenyl)sulfonylamino]ethanoate
Openeye Name:	(2S)-2-(1-adamantyl)-2-(p-tolylsulfonylamino)acetate
CAS Name:	(2S)-2-(1-adamantyl)-2-[(4-methylphenyl)sulfonylamino]acetate
IUPAC Name:	(2S)-2-(1-adamantyl)-2-[(4-methylphenyl)sulfonylamino]acetate
Traditional Name:	(2S)-2-(1-adamantyl)-2-(tosylamino)acetate
Formula:	C₁₉H₂₄NO₄S-
MolecularWeight:	362.46316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C(=O)[O-])C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@H](C(=O)[O-])C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C19H25NO4S/c1-12-2-4-16(5-3-12)25(23,24)20-17(18(21)22)19-9-13-6-14(10-19)8-15(7-13)11-19/h2-5,13-15,17,20H,6-11H2,1H3,(H,21,22)/p-1/t13?,14?,15?,17-,19?/m1/s1

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