8-prop-1-ynyl-1H-1,2-benzodiazepine

Systemtic Name: 8-prop-1-ynyl-1H-1,2-benzodiazepine Openeye Name: 8-prop-1-ynyl-1H-1,2-benzodiazepine CAS Name: 8-prop-1-ynyl-1H-1,2-benzodiazepine IUPAC Name: 8-prop-1-ynyl-1H-1,2-benzodiazepine Traditional Name: 8-prop-1-ynyl-1H-1,2-benzodiazepine Formula: C12H10N2 MolecularWeight: 182.2212

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC1=CC2=C(C=CC=NN2)C=C1

Isomeric SMILES

CC#CC1=CC2=C(C=CC=NN2)C=C1

InChI

InChI=1S/C12H10N2/c1-2-4-10-6-7-11-5-3-8-13-14-12(11)9-10/h3,5-9,14H,1H3