azanyl 2-(4-but-2-ynoxyphenyl)sulfonyl-5-chloranyl-2-propan-2-yl-pentanoate

Systemtic Name: azanyl 2-(4-but-2-ynoxyphenyl)sulfonyl-5-chloranyl-2-propan-2-yl-pentanoate Openeye Name: amino 2-(4-but-2-ynoxyphenyl)sulfonyl-5-chloro-2-isopropyl-pentanoate CAS Name: 2-(4-but-2-ynoxyphenyl)sulfonyl-5-chloro-2-propan-2-ylpentanoic acid amino ester IUPAC Name: amino 2-(4-but-2-ynoxyphenyl)sulfonyl-5-chloro-2-propan-2-ylpentanoate Traditional Name: 2-(4-but-2-ynoxyphenyl)sulfonyl-5-chloro-2-isopropyl-valeric acid amino ester Formula: C18H24ClNO5S MolecularWeight: 401.90486

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)C(CCCCl)(C(C)C)C(=O)ON

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)C(CCCCl)(C(C)C)C(=O)ON

InChI

InChI=1S/C18H24ClNO5S/c1-4-5-13-24-15-7-9-16(10-8-15)26(22,23)18(14(2)3,11-6-12-19)17(21)25-20/h7-10,14H,6,11-13,20H2,1-3H3