thiophen-2-yl (2Z)-2-hydroxyiminododec-8-ynoate

Systemtic Name: thiophen-2-yl (2Z)-2-hydroxyiminododec-8-ynoate Openeye Name: 2-thienyl (2Z)-2-hydroxyiminododec-8-ynoate CAS Name: (2Z)-2-hydroxyimino-8-dodecynoic acid thiophen-2-yl ester IUPAC Name: thiophen-2-yl (2Z)-2-hydroxyiminododec-8-ynoate Traditional Name: (2Z)-2-hydroximinododec-8-ynoic acid 2-thienyl ester Formula: C16H21NO3S MolecularWeight: 307.40784

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Descriptors Computed from Structure

Canonical SMILES:

CCCC#CCCCCCC(=NO)C(=O)OC1=CC=CS1

Isomeric SMILES

CCCC#CCCCCC/C(=N/O)/C(=O)OC1=CC=CS1

InChI

InChI=1S/C16H21NO3S/c1-2-3-4-5-6-7-8-9-11-14(17-19)16(18)20-15-12-10-13-21-15/h10,12-13,19H,2-3,6-9,11H2,1H3/b17-14-