pent-3-ynyl 5,7-dihydrobenzo[d][2]benzazepine-6-carboximidate

Systemtic Name: pent-3-ynyl 5,7-dihydrobenzo[d][2]benzazepine-6-carboximidate Openeye Name: pent-3-ynyl 5,7-dihydrobenzo[d][2]benzazepine-6-carboximidate CAS Name: 5,7-dihydrobenzo[d][2]benzazepine-6-carboximidic acid pent-3-ynyl ester IUPAC Name: pent-3-ynyl 5,7-dihydrobenzo[d][2]benzazepine-6-carboximidate Traditional Name: 5,7-dihydrobenzo[d][2]benzazepine-6-carboximidic acid pent-3-ynyl ester Formula: C20H20N2O MolecularWeight: 304.3856

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCCOC(=N)N1CC2=CC=CC=C2C3=CC=CC=C3C1

Isomeric SMILES

CC#CCCOC(=N)N1CC2=CC=CC=C2C3=CC=CC=C3C1

InChI

InChI=1S/C20H20N2O/c1-2-3-8-13-23-20(21)22-14-16-9-4-6-11-18(16)19-12-7-5-10-17(19)15-22/h4-7,9-12,21H,8,13-15H2,1H3