4-[5-methyl-2-(naphthalen-1-ylmethyl)-1,3-bis(oxidanylidene)-4,4-dipyridin-4-yl-isoquinolin-7-yl]benzenecarbonitrile

Systemtic Name: 4-[5-methyl-2-(naphthalen-1-ylmethyl)-1,3-bis(oxidanylidene)-4,4-dipyridin-4-yl-isoquinolin-7-yl]benzenecarbonitrile Openeye Name: 4-[5-methyl-2-(1-naphthylmethyl)-1,3-dioxo-4,4-bis(4-pyridyl)-7-isoquinolyl]benzonitrile CAS Name: 4-[5-methyl-2-(1-naphthalenylmethyl)-1,3-dioxo-4,4-dipyridin-4-yl-7-isoquinolinyl]benzonitrile IUPAC Name: 4-[5-methyl-2-(naphthalen-1-ylmethyl)-1,3-dioxo-4,4-dipyridin-4-ylisoquinolin-7-yl]benzonitrile Traditional Name: 4-[1,3-diketo-5-methyl-2-(1-naphthylmethyl)-4,4-bis(4-pyridyl)-7-isoquinolyl]benzonitrile Formula: C38H26N4O2 MolecularWeight: 570.63864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1C(C(=O)N(C2=O)CC3=CC=CC4=CC=CC=C43)(C5=CC=NC=C5)C6=CC=NC=C6)C7=CC=C(C=C7)C#N

Isomeric SMILES

CC1=CC(=CC2=C1C(C(=O)N(C2=O)CC3=CC=CC4=CC=CC=C43)(C5=CC=NC=C5)C6=CC=NC=C6)C7=CC=C(C=C7)C#N

InChI

InChI=1S/C38H26N4O2/c1-25-21-30(27-11-9-26(23-39)10-12-27)22-34-35(25)38(31-13-17-40-18-14-31,32-15-19-41-20-16-32)37(44)42(36(34)43)24-29-7-4-6-28-5-2-3-8-33(28)29/h2-22H,24H2,1H3