2-but-2-ynyl-7-methoxy-3,4,5,6-tetrahydro-2H-azepine

Systemtic Name: 2-but-2-ynyl-7-methoxy-3,4,5,6-tetrahydro-2H-azepine Openeye Name: 2-but-2-ynyl-7-methoxy-3,4,5,6-tetrahydro-2H-azepine CAS Name: 2-but-2-ynyl-7-methoxy-3,4,5,6-tetrahydro-2H-azepine IUPAC Name: 2-but-2-ynyl-7-methoxy-3,4,5,6-tetrahydro-2H-azepine Traditional Name: 2-but-2-ynyl-7-methoxy-3,4,5,6-tetrahydro-2H-azepine Formula: C11H17NO MolecularWeight: 179.25878

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCC1CCCCC(=N1)OC

Isomeric SMILES

CC#CCC1CCCCC(=N1)OC

InChI

InChI=1S/C11H17NO/c1-3-4-7-10-8-5-6-9-11(12-10)13-2/h10H,5-9H2,1-2H3