(6-phenylbenzo[a]phenazin-5-yl) pentanoate

Systemtic Name: (6-phenylbenzo[a]phenazin-5-yl) pentanoate Openeye Name: (6-phenylbenzo[a]phenazin-5-yl) pentanoate CAS Name: pentanoic acid (6-phenyl-5-benzo[a]phenazinyl) ester IUPAC Name: (6-phenylbenzo[a]phenazin-5-yl) pentanoate Traditional Name: valeric acid (6-phenylbenzo[a]phenazin-5-yl) ester Formula: C27H22N2O2 MolecularWeight: 406.47578

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC1=C(C2=NC3=CC=CC=C3N=C2C4=CC=CC=C41)C5=CC=CC=C5

Isomeric SMILES

CCCCC(=O)OC1=C(C2=NC3=CC=CC=C3N=C2C4=CC=CC=C41)C5=CC=CC=C5

InChI

InChI=1S/C27H22N2O2/c1-2-3-17-23(30)31-27-20-14-8-7-13-19(20)25-26(24(27)18-11-5-4-6-12-18)29-22-16-10-9-15-21(22)28-25/h4-16H,2-3,17H2,1H3