1,3-dimethyl-4-prop-2-ynyl-5H-pyrazolo[3,4-b][1,4]benzoxazepine

Systemtic Name: 1,3-dimethyl-4-prop-2-ynyl-5H-pyrazolo[3,4-b][1,4]benzoxazepine Openeye Name: 1,3-dimethyl-4-prop-2-ynyl-5H-pyrazolo[3,4-b][1,4]benzoxazepine CAS Name: 1,3-dimethyl-4-prop-2-ynyl-5H-pyrazolo[3,4-b][1,4]benzoxazepine IUPAC Name: 1,3-dimethyl-4-prop-2-ynyl-5H-pyrazolo[3,4-b][1,4]benzoxazepine Traditional Name: 1,3-dimethyl-4-propargyl-5H-pyrazolo[3,4-b][1,4]benzoxazepine Formula: C15H15N3O MolecularWeight: 253.2991

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1N(CC3=CC=CC=C3O2)CC#C)C

Isomeric SMILES

CC1=NN(C2=C1N(CC3=CC=CC=C3O2)CC#C)C

InChI

InChI=1S/C15H15N3O/c1-4-9-18-10-12-7-5-6-8-13(12)19-15-14(18)11(2)16-17(15)3/h1,5-8H,9-10H2,2-3H3