N-acenaphthyleno[2,1-b]quinoxalin-7-ium-7-yl-3-(propan-2-ylamino)propanimidate

Systemtic Name: N-acenaphthyleno[2,1-b]quinoxalin-7-ium-7-yl-3-(propan-2-ylamino)propanimidate Openeye Name: N-acenaphthyleno[2,1-b]quinoxalin-7-ium-7-yl-3-(isopropylamino)propanimidate CAS Name: N-(7-acenaphthyleno[2,1-b]quinoxalin-7-iumyl)-3-(propan-2-ylamino)propanimidate IUPAC Name: N-acenaphthyleno[2,1-b]quinoxalin-7-ium-7-yl-3-(propan-2-ylamino)propanimidate Traditional Name: N-acenaphtho[2,1-b]quinoxalin-7-ium-7-yl-3-(isopropylamino)propionimidate Formula: C24H22N4O MolecularWeight: 382.45768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCCC(=N[N+]1=C2C3=CC=CC4=C3C(=CC=C4)C2=NC5=CC=CC=C51)[O-]

Isomeric SMILES

CC(C)NCCC(=N[N+]1=C2C3=CC=CC4=C3C(=CC=C4)C2=NC5=CC=CC=C51)[O-]

InChI

InChI=1S/C24H22N4O/c1-15(2)25-14-13-21(29)27-28-20-12-4-3-11-19(20)26-23-17-9-5-7-16-8-6-10-18(22(16)17)24(23)28/h3-12,15,25H,13-14H2,1-2H3